ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar09-2024 13:51:37 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.34 0.02 0.40 1 2 3 1 1.000 0.000 0.000 0.000 -6.493 2.471 41.409 11.031 S S S P S S P S 1 2 1 3 1.00 0.00 0.00 0.00 -6.4931 2.4706 11.0309 41.4090 1 H -0.0000 1.0000 0.0000 0.0000 0.0000 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar09-2024 13:51:37 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.76 0.02 0.81 1 2 3 4 5 1 2 3 4 1 2 3 2.000 1.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 5.000 0.000 0.000 -64.342 -4.108 0.830 10.873 76.897 -38.592 -0.555 16.632 109.646 -3.733 3.575 29.703 S S S S S P P P P D D D S P S D P S D S P D S P 1 1 2 1 2 3 2 4 3 3 5 4 2.00 6.00 1.00 5.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -64.3424 -38.5925 -4.1076 -3.7334 -0.5546 0.8297 3.5751 10.8726 16.6324 29.7028 76.8968 109.6456 1 Mo 0.0000 3.0000 6.0000 5.0000 0.0000 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 0 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:38 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar09-2024 13:51:39 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.33 0.05 1.42 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 0 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:38 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Mar09-2024 13:51:39 Nodes: 1 Procs: 1 Mar09-2024 13:51:40 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar09-2024 13:51:41 Hydrogen (TZP) kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.45 0.03 0.51 1 2 3 1 2 3 1 2.000 0.000 0.000 4.000 0.000 0.000 0.000 -24.020 24.654 804.880 -9.089 9.585 104.336 29.005 S S S P P P D S P P S D P S 1 1 2 2 1 3 3 2.00 4.00 0.00 0.00 0.00 0.00 0.00 -24.0201 -9.0888 9.5852 24.6539 29.0045 104.3364 804.8804 1 O -0.0000 2.0000 4.0000 0.0000 0.0000 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 0 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:38 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Mar09-2024 13:51:39 Nodes: 1 Procs: 1 Mar09-2024 13:51:40 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Mar09-2024 13:51:41 Nodes: 1 Procs: 1 Mar09-2024 13:51:41 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar09-2024 13:51:42 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.2185,-2.1363,1.2736;-.0513,3.3464,.011;-2.9897,-.0253,.4106;-.1889,-3.5841,.0346;-.1323,4.6747,1.1567;-2.7709,-1.8143,.399;-.1426,-5.0348,1.0053;3.2241,1.6228,.0727;2.7945,-2.1945,-1.4774;2.8677,-1.5013,.3717;-4.1868,2.4336,.8403;-2.867,2.0417,-.2568;1.5792,2.5191,.608;.4741,3.8912,-1.5718;-1.9896,-3.5145,-.5573;1.4875,-2.6989,.7785;3.8299,-.0325,-.6808;-3.6668,-2.4192,1.7622;4.4265,2.1325,1.2351;3.4954,2.5913,-1.364;-2.0815,3.6997,-.5837;.6444,-3.8802,-1.5027;-3.963,-2.0479,-1.1512;-3.505,1.5761,-1.8275;-.9502,-1.8959,.9194;2.2059,.0073,1.1813;-1.0009,1.6548,.3158;2.0918,-2.9033,-1.5425;-3.6738,-2.8592,-1.6208;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 PW92 == Not Default == Restricted Restricted Point Charge Nuclei Frozen Orbital(s) 3 1 1.93000 78.39000 conjugate-gradient 1000 1.0E-08 0.00000 t21.O ADF 2019 Mar09-2024 13:51:41 1 1 Oxygen TZP 1s t21.W ADF 2019 Mar09-2024 13:51:40 1 1 Tungsten TZP 4d t21.Mo ADF 2019 Mar09-2024 13:51:38 1 1 Molybdenum TZP 3d t21.H ADF 2019 Mar09-2024 13:51:37 1 1 Hydrogen TZP 1 1 -9.01259209 0.02198656 0.00100000 F 0.00492772 0.00066667 F 0.02198656 0.00492772 0.02774663 0.01000000 F 0.01003150 0.00666667 F Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.208,-2.1383,1.2831;-.0529,3.3382,-.0037;-2.9953,-.0263,.424;-.192,-3.5794,.029;-.1225,4.6792,1.1361;-2.7737,-1.814,.4094;-.1396,-5.0315,.9952;3.2234,1.6236,.0846;2.8178,-2.1881,-1.4854;2.8656,-1.5001,.3616;-4.1829,2.4402,.845;-2.8706,2.036,-.2532;1.5709,2.5203,.602;.4781,3.8756,-1.5928;-1.9946,-3.511,-.5546;1.4879,-2.6942,.7658;3.8386,-.0314,-.6687;-3.6624,-2.4228,1.7744;4.4108,2.1279,1.2616;3.5139,2.5945,-1.344;-2.0768,3.6909,-.5938;.6328,-3.8716,-1.5123;-3.9698,-2.0438,-1.1382;-3.5151,1.5638,-1.8169;-.9512,-1.893,.9213;2.1917,.0015,1.1745;-1.0012,1.6521,.3152;2.1195,-2.8981,-1.568;-3.6789,-2.8514,-1.612;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 2 2 -9.01309206 0.01099427 0.00100000 F 0.00266966 0.00066667 F 0.01099427 0.00266966 0.03910805 0.01000000 F 0.01528198 0.00666667 F Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1993,-2.1343,1.2983;-.0576,3.3282,-.025;-3.0041,-.0301,.4463;-.1832,-3.5659,.0244;-.1032,4.6808,1.1101;-2.7729,-1.8162,.4102;-.1304,-5.0298,.9715;3.2208,1.621,.0817;2.8007,-2.2088,-1.4685;2.8614,-1.497,.3615;-4.1702,2.4469,.8816;-2.8779,2.0284,-.2311;1.5617,2.5243,.5794;.4716,3.8573,-1.6226;-1.9807,-3.4967,-.5726;1.4906,-2.683,.7771;3.8413,-.0431,-.66;-3.6696,-2.4473,1.7588;4.3977,2.1297,1.264;3.5254,2.5805,-1.3488;-2.0726,3.6808,-.5881;.6551,-3.8325,-1.5122;-3.9519,-2.0259,-1.1531;-3.5458,1.5594,-1.7833;-.9554,-1.8927,.9347;2.1775,.0027,1.1723;-.9981,1.6473,.3147;2.0991,-2.9125,-1.5442;-3.6493,-2.8225,-1.6378;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 3 3 -9.01326784 0.01207850 0.00100000 F 0.00301074 0.00066667 F 0.01207850 0.00301074 0.02546936 0.01000000 F 0.00753575 0.00666667 F Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1954,-2.1355,1.2969;-.0578,3.3271,-.0307;-3.0051,-.0299,.4494;-.1882,-3.5697,.0234;-.1052,4.6822,1.0995;-2.7746,-1.817,.4151;-.1319,-5.0296,.9768;3.2242,1.6231,.0921;2.8174,-2.1952,-1.4782;2.8638,-1.4946,.3555;-4.1677,2.4497,.8788;-2.8763,2.025,-.2334;1.5611,2.5255,.5794;.4751,3.8487,-1.6283;-1.9884,-3.5016,-.5652;1.4892,-2.6828,.7656;3.8501,-.0387,-.6521;-3.6668,-2.4439,1.769;4.3924,2.128,1.285;3.539,2.5875,-1.3336;-2.0686,3.6764,-.5949;.639,-3.8484,-1.5178;-3.9601,-2.0287,-1.1433;-3.5465,1.5553,-1.7849;-.9551,-1.8923,.9312;2.172,.0013,1.1687;-.9959,1.6454,.3133;2.1087,-2.8918,-1.5697;-3.6598,-2.8264,-1.6281;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 4 4 -9.01344854 0.00862633 0.00100000 F 0.00226051 0.00066667 F 0.00862633 0.00226051 0.01740018 0.01000000 F 0.00615363 0.00666667 T Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1952,-2.1329,1.3005;-.0619,3.3265,-.0413;-3.0091,-.0301,.4606;-.1888,-3.5689,.0232;-.1067,4.6852,1.0829;-2.776,-1.8185,.4162;-.1338,-5.0313,.9731;3.2279,1.6224,.0947;2.8218,-2.1951,-1.4762;2.8674,-1.4918,.3566;-4.1591,2.4535,.8962;-2.8771,2.0192,-.2242;1.5633,2.5269,.5691;.4689,3.8373,-1.6421;-1.988,-3.4989,-.5684;1.4866,-2.6809,.7673;3.8588,-.0411,-.6448;-3.6739,-2.4532,1.7629;4.3889,2.1297,1.2945;3.5513,2.5841,-1.332;-2.0673,3.6695,-.5941;.6395,-3.8449,-1.519;-3.9554,-2.0203,-1.1482;-3.5611,1.555,-1.772;-.9593,-1.8955,.9373;2.1665,.0042,1.1654;-.9928,1.6402,.3116;2.1066,-2.8866,-1.5733;-3.6532,-2.8147,-1.6373;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 5 5 -9.01359559 0.00665394 0.00100000 F 0.00151285 0.00066667 F 0.00665394 0.00151285 0.03823137 0.01000000 F 0.01396378 0.00666667 F Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1923,-2.128,1.308;-.0709,3.3243,-.0643;-3.016,-.0315,.4865;-.1854,-3.5652,.0242;-.1039,4.6927,1.0482;-2.776,-1.822,.4179;-.1353,-5.0343,.9637;3.2301,1.6213,.0988;2.8176,-2.1975,-1.4697;2.8708,-1.4853,.3581;-4.137,2.4607,.9344;-2.8775,2.0044,-.2027;1.5653,2.5305,.5479;.4585,3.8138,-1.6715;-1.9819,-3.4909,-.5772;1.4822,-2.675,.7742;3.8705,-.0467,-.6318;-3.6888,-2.4762,1.7449;4.3789,2.1329,1.3089;3.5704,2.5742,-1.3309;-2.0627,3.6529,-.5926;.6455,-3.8344,-1.5192;-3.9374,-1.9981,-1.1631;-3.5908,1.5512,-1.7408;-.967,-1.9028,.9539;2.1535,.0096,1.1587;-.985,1.628,.3087;2.0886,-2.8762,-1.5707;-3.6294,-2.7834,-1.6632;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 6 6 -9.01361894 0.00493301 0.00100000 F 0.00130512 0.00066667 F 0.00493301 0.00130512 0.01232060 0.01000000 F 0.00475932 0.00666667 T Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1903,-2.1263,1.3105;-.0746,3.3243,-.0722;-3.0175,-.0318,.4962;-.1838,-3.5641,.0243;-.1023,4.6963,1.0358;-2.7753,-1.8231,.4195;-.1356,-5.0355,.9601;3.2287,1.6213,.101;2.8161,-2.1981,-1.4688;2.8713,-1.4831,.3576;-4.1285,2.4634,.9464;-2.8771,1.9984,-.1959;1.565,2.5318,.5421;.4564,3.8064,-1.681;-1.98,-3.4878,-.5793;1.4807,-2.6733,.775;3.8733,-.0478,-.6277;-3.6931,-2.4838,1.7396;4.3735,2.1334,1.3148;3.5758,2.5712,-1.3293;-2.0609,3.6467,-.594;.6463,-3.8313,-1.5202;-3.9304,-1.9891,-1.167;-3.5995,1.548,-1.7304;-.969,-1.906,.9605;2.148,.0107,1.155;-.9824,1.6239,.3076;2.0848,-2.8746,-1.5696;-3.6211,-2.7712,-1.6713;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 7 7 -9.01362374 0.00508910 0.00100000 F 0.00130857 0.00066667 F 0.00508910 0.00130857 0.01699824 0.01000000 F 0.00615384 0.00666667 T Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1854,-2.1248,1.3129;-.0801,3.3269,-.0818;-3.0165,-.0315,.5092;-.1807,-3.5642,.0248;-.0985,4.7041,1.0203;-2.7726,-1.8245,.4234;-.1356,-5.0383,.9563;3.2221,1.6224,.1054;2.813,-2.1975,-1.471;2.8699,-1.4806,.3549;-4.1165,2.4672,.9593;-2.8752,1.9894,-.1885;1.563,2.5342,.5386;.4581,3.8003,-1.6907;-1.9781,-3.4837,-.5795;1.4783,-2.673,.7723;3.8729,-.0471,-.6245;-3.6979,-2.4923,1.7344;4.3636,2.1325,1.3235;3.5795,2.5684,-1.3253;-2.0586,3.6387,-.6;.6451,-3.8298,-1.5223;-3.9192,-1.976,-1.1706;-3.6071,1.5403,-1.7186;-.9704,-1.912,.9715;2.1396,.0106,1.1485;-.979,1.62,.3062;2.0839,-2.8765,-1.5687;-3.6093,-2.7542,-1.6804;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 8 8 -9.01367565 0.00381818 0.00100000 F 0.00101143 0.00066667 F 0.00381818 0.00101143 0.01213282 0.01000000 F 0.00574332 0.00666667 T Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1792,-2.1251,1.3084;-.0838,3.3335,-.0867;-3.0104,-.0315,.5172;-.1776,-3.5683,.027;-.0947,4.7148,1.0109;-2.7685,-1.8267,.4285;-.1347,-5.0425,.9582;3.2116,1.6256,.1123;2.8037,-2.1914,-1.4794;2.8651,-1.4785,.3486;-4.1066,2.4693,.9602;-2.87,1.9805,-.1873;1.5592,2.5383,.5447;.469,3.8019,-1.6921;-1.9778,-3.4829,-.5749;1.4761,-2.6749,.7648;3.8657,-.0432,-.6264;-3.7001,-2.4957,1.7342;4.3539,2.1293,1.3325;3.5766,2.57,-1.3178;-2.0542,3.6329,-.6111;.641,-3.8369,-1.5229;-3.9091,-1.9678,-1.1706;-3.6024,1.5281,-1.7158;-.9696,-1.9192,.9824;2.1328,.0092,1.1439;-.9749,1.6204,.3062;2.0803,-2.8757,-1.5724;-3.6004,-2.7444,-1.6833;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 9 9 -9.01383922 0.00217660 0.00100000 F 0.00061311 0.00066667 T 0.00217660 0.00061311 0.02151172 0.01000000 F 0.00907104 0.00666667 F Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1733,-2.1271,1.2909;-.0836,3.3437,-.0843;-2.9981,-.0315,.5174;-.1755,-3.5779,.0302;-.0961,4.7274,1.0104;-2.7617,-1.829,.4353;-.1332,-5.0494,.9656;3.1994,1.6307,.1224;2.7844,-2.1791,-1.4943;2.8552,-1.4763,.3385;-4.1031,2.469,.942;-2.8604,1.9737,-.1959;1.5543,2.5444,.5631;.4893,3.811,-1.6829;-1.9796,-3.4866,-.5651;1.4741,-2.6801,.7548;3.8493,-.0357,-.6346;-3.6969,-2.4909,1.7422;4.3482,2.1232,1.3414;3.5657,2.5788,-1.3051;-2.0467,3.6307,-.6268;.6341,-3.8538,-1.5225;-3.9022,-1.9672,-1.1642;-3.5809,1.5128,-1.7273;-.9634,-1.9271,.9907;2.129,.0071,1.1455;-.9696,1.6263,.3094;2.0703,-2.8727,-1.5815;-3.5966,-2.7455,-1.6762;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 10 10 -9.01364388 0.00349122 0.00100000 F 0.00081527 0.00066667 F 0.00349122 0.00081527 0.01095480 0.01000000 F 0.00413223 0.00666667 T Cartesian 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1784,-2.126,1.2952;-.0815,3.3397,-.0825;-3.0027,-.032,.5142;-.1787,-3.5737,.0274;-.098,4.7207,1.0152;-2.7675,-1.8282,.434;-.1331,-5.0462,.9612;3.2067,1.6295,.1188;2.795,-2.1821,-1.4898;2.8604,-1.4776,.3422;-4.1094,2.4679,.94;-2.8635,1.9777,-.1968;1.5561,2.5415,.5596;.4842,3.8105,-1.6826;-1.9819,-3.4855,-.5676;1.4759,-2.6782,.7559;3.8557,-.0379,-.6335;-3.6978,-2.4894,1.7447;4.353,2.1257,1.3382;3.5705,2.5786,-1.3083;-2.0488,3.633,-.6224;.6337,-3.8458,-1.5247;-3.9131,-1.9728,-1.1616;-3.5827,1.517,-1.7291;-.9676,-1.9228,.9854;2.134,.0077,1.1479;-.9724,1.6264,.3101;2.0813,-2.8762,-1.5804;-3.6069,-2.7522,-1.6716;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 11 11 CONVERGED -9.01370706 0.00094828 0.00100000 T 0.00031824 0.00066667 T 0.00094828 0.00031824 0.00668350 0.01000000 T 0.00221343 0.00666667 T NOSYM -4 O W O Mo O Mo O Mo O W O Mo O O O O O O O O O O O O O O O H H 15.99491400 183.95093200 15.99491400 97.90540600 15.99491400 97.90540600 15.99491400 97.90540600 15.99491400 183.95093200 15.99491400 97.90540600 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 1.00782500 1.00782500 1.000000 298.150000 24764.0544 27964.3438 49435.4725 1 NOSYM 298.15 46.859 38.768 122.869 208.495 0.889 0.889 73.013 74.791 2.981 2.981 107.217 113.178 7073.19 231.99 7505.34 2.360618 -28.207 5.913 17.353 33.678 34.227 42.435 49.416 52.499 61.886 64.432 69.383 85.925 89.490 104.806 117.235 135.235 140.915 144.281 165.321 169.234 177.391 183.580 186.525 199.578 203.441 208.301 219.636 225.452 230.039 234.791 243.878 249.270 257.479 266.901 279.827 284.837 297.058 313.060 316.139 319.174 323.466 325.178 333.072 336.405 338.231 342.906 371.457 390.787 409.721 418.325 456.590 463.047 503.383 526.736 548.012 572.911 576.695 581.776 615.563 640.154 651.403 668.448 682.593 713.437 741.246 781.206 794.325 832.714 841.482 845.971 856.766 861.874 889.469 896.595 902.192 911.107 914.482 915.644 1019.726 3191.803 3612.423 O W O Mo O Mo O Mo O W O Mo O O O O O O O O O O O O O O O H H -0.100 0.102 0.318 -0.006 0.042 0.051 0.008 0.004 0.004 0.016 0.023 -0.022 -0.049 0.039 0.057 0.002 0.009 -0.028 -0.017 0.021 -0.025 -0.082 -0.076 -0.078 0.330 -0.311 0.137 0.052 -0.031 0.023 -0.025 -0.012 0.009 -0.002 0.026 0.015 0.005 0.092 0.034 -0.036 0.067 0.047 0.041 0.050 -0.083 -0.009 0.035 0.012 0.139 -0.118 0.083 -0.020 -0.021 -0.057 -0.000 0.115 -0.235 -0.294 -0.271 -0.262 -0.030 0.032 0.036 0.083 0.022 0.010 0.015 0.029 -0.039 0.020 0.012 0.007 -0.013 -0.013 0.018 -0.179 0.066 -0.278 -0.006 0.039 0.036 0.231 -0.208 0.096 0.034 0.049 -0.059 0.061 -0.012 -0.113 -0.011 0.055 0.067 0.023 -0.019 -0.268 0.016 -0.078 0.124 -0.051 -0.154 0.328 0.026 -0.022 -0.086 0.035 0.003 0.252 -0.007 -0.006 -0.076 -0.128 -0.001 -0.016 -0.016 -0.015 -0.009 0.074 -0.078 0.057 0.003 0.047 -0.075 -0.009 -0.039 -0.052 0.011 0.373 0.168 0.009 -0.163 0.135 0.022 -0.028 0.068 -0.091 -0.011 -0.106 0.018 0.112 -0.024 0.024 -0.023 -0.097 -0.019 0.008 -0.069 -0.007 0.101 0.101 0.011 -0.191 0.142 0.058 -0.172 -0.098 -0.089 0.234 -0.088 0.029 0.047 -0.085 0.068 -0.020 0.059 0.032 -0.047 -0.266 -0.072 -0.065 0.044 0.039 -0.250 0.011 0.013 0.002 -0.105 0.020 0.019 0.105 0.010 0.011 0.016 -0.019 0.005 0.020 -0.066 0.051 0.060 -0.010 0.005 0.093 0.038 0.006 0.020 -0.049 0.002 0.023 -0.052 0.009 -0.072 -0.005 0.007 -0.075 -0.217 -0.030 -0.475 0.061 -0.049 -0.162 0.004 0.046 0.182 0.110 -0.023 0.123 -0.051 -0.023 0.110 0.005 0.009 -0.039 -0.043 0.021 -0.057 0.056 0.072 0.174 0.045 -0.009 -0.061 -0.174 0.005 -0.006 0.062 -0.037 -0.099 -0.079 0.022 -0.014 -0.108 -0.075 0.171 0.414 -0.206 -0.279 0.018 0.021 0.013 -0.020 0.000 -0.049 -0.015 0.058 0.197 -0.062 0.017 -0.056 -0.129 -0.090 0.181 -0.150 0.106 0.092 0.041 0.091 -0.025 0.155 -0.080 0.076 -0.018 -0.078 0.005 -0.069 0.005 0.080 -0.045 -0.105 0.063 0.050 -0.176 -0.156 0.021 0.039 -0.020 -0.035 0.014 0.011 -0.100 0.056 -0.012 0.193 -0.104 0.070 0.142 -0.098 0.010 0.079 0.152 -0.041 0.063 0.261 0.031 -0.005 -0.033 -0.028 -0.090 0.030 -0.016 -0.004 0.010 0.021 -0.303 -0.061 -0.095 0.003 -0.034 0.027 0.116 0.022 -0.007 0.051 -0.052 -0.040 -0.024 0.083 -0.032 0.100 0.044 -0.057 0.085 -0.129 0.047 -0.153 -0.339 0.366 -0.170 0.087 -0.139 0.175 -0.027 -0.134 -0.062 0.037 -0.007 0.151 0.096 -0.107 0.001 -0.111 0.046 -0.002 -0.057 -0.008 -0.059 -0.006 -0.028 -0.030 0.105 -0.070 -0.136 -0.248 0.228 -0.085 -0.011 0.080 0.082 0.021 -0.207 0.063 -0.002 -0.006 0.052 0.081 0.016 0.058 0.003 0.044 0.098 0.006 0.032 -0.017 -0.025 -0.083 0.006 -0.072 -0.068 0.050 0.250 0.098 -0.073 0.041 0.033 -0.028 0.080 -0.035 0.157 -0.016 0.114 -0.007 0.062 0.173 0.034 0.150 -0.041 -0.002 -0.074 -0.070 0.007 -0.042 -0.080 -0.090 0.292 -0.133 -0.237 -0.135 0.197 -0.168 0.027 -0.028 -0.059 0.012 0.037 0.120 0.017 0.078 0.027 -0.134 -0.299 -0.011 0.152 -0.035 -0.232 -0.119 0.177 0.026 -0.099 -0.105 0.027 -0.095 0.060 -0.086 -0.019 0.029 -0.027 0.063 0.079 0.034 -0.057 0.013 -0.096 -0.016 -0.069 -0.046 0.083 0.108 0.083 0.039 -0.081 -0.134 0.125 -0.011 0.021 0.050 0.004 -0.098 -0.017 -0.074 -0.017 -0.026 0.018 0.065 -0.030 0.020 -0.035 -0.156 0.019 0.024 0.049 -0.075 -0.071 0.167 0.042 0.069 0.011 -0.015 -0.299 -0.102 -0.255 0.177 0.179 -0.226 -0.110 -0.036 -0.178 0.007 -0.045 0.060 0.037 0.022 0.115 0.139 0.124 -0.250 0.079 -0.041 -0.022 -0.172 -0.062 0.178 0.202 0.083 0.107 -0.023 -0.038 0.122 -0.119 0.098 0.026 0.210 0.163 -0.267 -0.074 0.033 0.104 0.029 0.012 0.014 0.007 -0.083 -0.231 -0.017 -0.030 -0.035 0.210 0.133 -0.131 -0.059 -0.089 -0.041 0.156 -0.049 -0.068 0.074 0.020 -0.048 0.010 0.061 0.028 -0.036 0.028 0.045 -0.109 -0.163 -0.004 0.009 0.041 0.037 0.058 0.032 -0.084 -0.163 -0.178 -0.108 -0.069 -0.193 0.104 -0.035 0.028 -0.010 0.078 -0.001 0.063 0.035 0.079 0.111 0.046 0.052 -0.035 0.090 -0.002 -0.058 -0.049 0.109 0.255 -0.051 0.103 -0.073 -0.188 -0.332 0.075 0.151 0.155 -0.066 -0.017 -0.006 -0.130 -0.025 0.065 -0.031 -0.016 0.062 0.142 0.002 0.076 0.003 -0.200 -0.376 0.136 0.035 -0.047 0.023 -0.071 0.053 -0.005 0.007 0.037 0.178 0.005 0.010 -0.040 0.112 -0.090 0.172 0.042 0.041 0.033 -0.146 -0.016 -0.075 0.073 -0.012 -0.118 -0.023 0.011 0.039 -0.001 -0.046 0.071 -0.266 -0.102 -0.224 -0.021 -0.041 0.016 -0.004 -0.112 -0.340 -0.218 0.252 -0.005 0.038 0.156 -0.134 0.020 -0.089 0.039 -0.008 -0.045 -0.019 0.054 -0.086 -0.023 -0.066 -0.045 0.028 0.314 0.016 -0.040 -0.079 0.060 0.198 0.034 -0.032 -0.016 0.024 0.188 0.032 0.301 -0.106 -0.108 0.037 -0.003 0.025 0.081 -0.060 0.099 -0.028 0.034 0.058 0.006 -0.015 0.030 0.024 0.246 -0.056 0.081 -0.252 -0.145 -0.030 0.080 -0.037 0.067 0.017 -0.017 0.010 -0.047 -0.015 0.107 0.123 -0.091 0.040 0.007 0.023 0.212 -0.158 -0.198 -0.095 -0.028 0.028 -0.170 0.193 -0.047 0.039 -0.057 0.042 -0.002 0.005 0.002 0.012 0.021 0.012 -0.115 -0.090 0.026 0.039 -0.007 -0.033 -0.056 -0.147 0.189 0.011 -0.052 -0.010 0.036 -0.028 0.115 -0.101 0.070 -0.046 -0.055 0.213 -0.106 -0.272 -0.161 -0.103 0.006 0.061 0.024 -0.122 0.197 -0.123 0.231 0.104 -0.122 0.052 0.035 -0.010 0.008 -0.081 0.086 0.165 -0.092 0.236 -0.020 0.058 0.024 -0.166 0.190 -0.064 0.188 0.019 -0.020 0.006 0.062 0.048 -0.027 -0.035 0.006 0.004 0.040 -0.070 0.001 0.023 0.079 0.007 -0.044 0.024 -0.011 0.034 0.048 0.243 -0.050 -0.047 0.041 -0.039 0.050 0.184 -0.189 -0.010 0.066 -0.015 -0.088 -0.168 -0.045 -0.076 -0.091 0.056 -0.036 0.013 -0.002 -0.086 -0.150 -0.033 -0.040 -0.060 -0.130 0.265 0.014 0.063 -0.029 0.084 -0.012 -0.033 -0.234 0.139 -0.057 -0.080 -0.177 0.218 0.239 0.053 0.156 -0.092 0.072 0.118 -0.121 0.226 -0.022 0.256 0.095 -0.153 -0.027 0.111 -0.081 -0.069 -0.061 0.217 -0.090 -0.008 -0.211 -0.062 0.010 -0.049 0.043 -0.046 -0.035 0.239 -0.009 -0.006 -0.140 0.143 0.154 0.036 -0.105 0.048 0.035 0.073 0.109 -0.009 -0.087 -0.060 -0.169 -0.139 0.090 0.137 0.093 0.022 0.193 -0.129 -0.130 0.070 0.023 -0.093 -0.087 0.150 0.012 -0.128 0.039 0.064 -0.040 0.098 -0.047 -0.054 0.030 -0.034 0.080 0.052 0.017 -0.006 -0.036 0.046 -0.084 -0.200 0.242 0.007 -0.099 0.002 0.045 0.005 0.074 0.173 0.050 0.024 0.099 0.049 -0.130 -0.015 0.022 -0.110 -0.006 -0.073 -0.139 -0.100 0.071 -0.124 0.315 0.258 -0.112 -0.120 -0.088 0.031 0.179 0.111 -0.200 -0.163 0.081 -0.102 -0.024 -0.017 0.021 -0.037 0.111 -0.015 0.173 0.105 0.035 0.153 0.146 -0.034 -0.002 0.013 0.009 -0.064 -0.026 0.005 -0.023 0.052 -0.017 -0.008 0.017 -0.003 -0.053 -0.025 -0.031 0.150 -0.008 -0.119 -0.036 0.038 -0.087 0.239 -0.319 0.145 0.006 -0.020 0.063 0.084 0.080 0.020 0.037 -0.030 0.020 -0.015 -0.031 0.039 0.102 0.003 0.044 -0.078 -0.122 0.123 0.012 -0.003 0.077 -0.386 0.048 -0.322 -0.046 -0.037 -0.033 0.071 -0.217 -0.084 0.034 0.206 0.039 0.069 -0.062 -0.121 -0.097 0.227 -0.080 0.035 -0.001 -0.088 0.007 -0.075 0.046 -0.017 0.075 -0.100 0.157 -0.039 0.198 -0.004 0.012 0.125 0.125 -0.191 0.109 0.013 -0.040 -0.044 0.078 0.112 -0.057 0.026 -0.062 0.020 0.151 0.050 -0.114 0.077 -0.011 -0.017 0.060 0.010 -0.055 0.072 0.037 0.052 -0.127 -0.154 -0.241 -0.050 0.018 -0.038 -0.016 -0.048 0.063 -0.041 -0.001 0.036 -0.067 -0.110 -0.014 -0.043 0.066 -0.066 -0.009 -0.008 0.146 -0.027 -0.213 -0.037 0.148 0.253 -0.214 0.045 -0.102 0.103 -0.218 0.037 -0.134 -0.058 0.151 0.017 0.067 -0.093 -0.103 -0.142 0.113 0.006 -0.051 0.107 0.188 0.123 0.067 -0.013 -0.061 -0.034 0.136 -0.060 0.228 -0.105 -0.022 -0.231 0.334 0.001 -0.030 0.092 0.018 -0.052 -0.230 -0.025 -0.047 0.040 0.003 0.040 0.062 0.037 -0.048 -0.031 -0.014 0.034 0.036 0.041 -0.001 -0.130 0.055 -0.059 0.010 -0.158 0.036 0.016 -0.007 -0.021 -0.010 -0.012 -0.131 -0.104 0.063 -0.008 -0.053 -0.069 0.065 -0.009 0.016 -0.033 0.008 0.006 0.285 -0.026 -0.078 0.092 -0.023 0.021 0.000 -0.104 0.032 0.057 0.047 0.098 0.052 -0.103 0.025 -0.047 0.043 0.068 -0.018 0.022 -0.091 0.089 -0.017 0.001 -0.021 0.007 0.161 0.006 -0.017 0.035 -0.083 -0.410 0.101 -0.003 0.018 -0.092 -0.225 0.068 -0.220 -0.075 0.085 -0.061 -0.181 0.176 0.021 -0.022 -0.027 -0.156 0.228 0.454 -0.054 0.040 -0.011 0.008 -0.181 0.059 -0.059 -0.087 0.064 -0.011 0.004 -0.002 0.051 0.044 0.028 -0.081 -0.168 -0.103 -0.018 0.005 -0.002 -0.013 0.028 0.061 -0.048 -0.033 0.108 0.043 0.090 0.035 0.350 -0.161 -0.004 0.047 0.027 0.008 -0.052 0.035 -0.037 -0.035 0.027 -0.014 0.014 0.015 0.021 -0.007 -0.011 -0.004 -0.088 -0.088 0.004 -0.095 0.111 -0.288 -0.057 0.049 -0.041 -0.085 0.114 0.055 0.110 0.150 -0.052 -0.007 0.050 -0.003 -0.016 0.023 0.007 -0.049 -0.433 -0.026 0.024 0.073 0.036 -0.038 0.042 -0.014 -0.058 -0.151 0.041 0.229 0.028 0.193 -0.005 0.019 -0.038 0.427 -0.201 0.024 0.017 0.058 0.054 -0.027 0.136 0.142 0.001 -0.058 -0.019 -0.182 0.002 0.011 0.027 -0.039 -0.002 0.328 -0.184 0.137 -0.041 -0.002 0.035 0.008 -0.038 0.003 -0.079 0.045 -0.089 0.047 0.078 -0.046 0.013 0.022 -0.001 0.060 0.247 -0.047 0.055 0.053 0.033 -0.169 -0.355 -0.037 0.248 0.001 0.085 0.023 -0.002 0.018 0.048 -0.062 -0.061 0.079 0.071 0.064 -0.072 -0.068 -0.019 -0.335 0.155 0.107 -0.070 0.233 0.040 0.164 0.055 0.004 -0.011 -0.099 -0.007 0.029 -0.072 -0.012 0.168 0.140 -0.043 -0.050 -0.022 0.049 -0.150 -0.082 -0.089 -0.077 -0.066 0.078 0.090 0.046 -0.046 0.099 -0.086 0.048 0.034 0.040 0.081 -0.064 -0.020 0.036 0.307 0.089 -0.253 -0.078 0.021 0.047 0.010 0.020 -0.000 0.060 0.066 -0.093 -0.226 -0.008 0.005 -0.016 0.071 -0.061 0.011 0.054 -0.041 0.052 -0.014 0.010 0.179 -0.152 0.121 0.062 -0.169 0.007 0.015 -0.016 -0.012 0.006 -0.168 0.010 -0.128 0.083 0.037 0.073 -0.120 -0.069 0.070 0.025 0.070 -0.059 0.493 0.026 -0.131 0.106 0.033 0.104 0.074 -0.027 0.063 -0.131 -0.025 -0.230 0.028 -0.024 -0.110 0.120 0.013 -0.050 0.008 -0.003 0.035 -0.011 0.047 -0.076 -0.070 -0.070 0.082 -0.017 0.172 0.010 0.072 -0.032 -0.202 0.154 -0.090 0.242 0.144 -0.031 0.061 0.026 0.023 0.006 -0.105 0.135 -0.137 -0.037 0.036 -0.158 0.130 -0.108 -0.047 -0.070 0.013 -0.200 -0.054 0.016 0.037 0.077 -0.059 0.032 0.179 -0.056 0.071 -0.094 0.031 -0.032 -0.171 0.044 -0.014 0.104 -0.062 -0.045 0.076 0.094 -0.087 -0.007 -0.028 -0.097 -0.075 -0.040 0.215 -0.211 0.019 0.119 0.155 0.077 0.006 -0.260 -0.040 -0.055 0.107 0.012 -0.114 0.345 0.087 -0.134 0.082 -0.013 -0.057 0.078 0.061 -0.031 0.133 -0.015 -0.067 -0.151 0.040 0.050 -0.049 -0.066 -0.087 -0.059 -0.192 -0.028 0.025 -0.175 0.045 0.167 -0.047 -0.205 0.037 0.028 0.035 0.068 0.146 -0.016 0.043 0.073 -0.102 -0.036 -0.015 0.018 0.035 -0.102 0.077 0.212 -0.123 -0.036 -0.050 0.100 0.013 0.182 0.117 -0.055 -0.110 -0.099 -0.211 0.297 -0.071 0.075 0.062 0.065 0.153 0.020 0.027 -0.009 -0.045 -0.107 0.036 0.029 0.016 0.011 -0.202 0.023 -0.035 0.004 0.035 0.039 0.012 -0.157 0.014 -0.094 -0.052 -0.102 -0.131 0.025 -0.035 -0.437 -0.004 0.181 -0.086 -0.025 0.022 -0.012 -0.006 -0.103 -0.266 -0.106 0.136 0.103 -0.050 -0.224 0.168 -0.078 -0.028 0.016 0.025 -0.062 -0.018 0.011 0.001 -0.017 -0.062 -0.013 0.115 0.000 0.134 0.056 0.020 -0.230 -0.301 0.005 -0.045 0.052 0.072 -0.167 -0.035 -0.023 0.038 0.057 0.022 0.167 0.223 -0.124 0.041 -0.038 0.071 -0.014 0.039 -0.007 0.080 0.121 -0.031 0.137 -0.236 0.034 -0.085 -0.096 -0.045 0.208 0.070 0.031 0.003 -0.075 -0.113 0.001 -0.047 -0.014 0.048 -0.217 0.040 0.052 0.068 0.008 -0.121 0.018 0.074 0.059 0.025 0.105 0.126 -0.256 0.028 -0.033 0.302 0.006 0.141 0.124 -0.013 0.061 -0.018 0.004 0.066 0.081 0.026 0.149 0.043 -0.031 -0.222 0.235 -0.111 0.025 0.098 0.026 0.053 -0.051 -0.014 -0.016 -0.042 -0.047 0.038 -0.141 -0.050 0.124 -0.011 0.036 -0.116 -0.225 -0.012 0.018 -0.029 0.018 0.193 -0.024 -0.014 0.021 0.078 -0.092 -0.109 -0.023 0.004 0.002 0.024 0.028 0.252 0.303 0.240 -0.040 -0.031 -0.068 0.042 0.029 0.003 -0.048 -0.047 0.013 0.093 -0.288 0.156 0.073 0.087 -0.031 -0.108 -0.078 -0.042 -0.142 -0.026 -0.038 0.050 -0.066 -0.036 -0.095 0.163 -0.007 0.025 0.036 0.008 -0.107 0.221 0.061 -0.231 -0.014 0.094 -0.071 0.217 0.083 -0.100 0.063 -0.076 0.263 -0.056 0.036 0.076 -0.019 -0.014 0.059 -0.292 0.083 -0.009 -0.049 0.042 0.058 -0.001 0.036 -0.028 0.042 0.049 0.078 -0.019 -0.029 0.137 -0.029 0.035 0.110 -0.045 -0.080 -0.114 -0.038 0.026 -0.212 0.086 0.135 0.051 -0.075 -0.018 -0.335 0.026 -0.043 -0.099 0.114 0.003 0.098 -0.136 -0.113 -0.008 0.062 -0.013 -0.106 0.033 0.019 0.034 -0.048 0.011 0.227 0.238 0.015 0.160 0.057 0.018 0.104 0.281 0.031 -0.205 -0.219 -0.053 0.069 -0.030 0.025 0.011 -0.036 0.094 -0.006 -0.002 0.034 -0.094 0.074 -0.015 0.017 -0.009 -0.010 0.181 -0.073 -0.059 0.000 0.078 0.038 0.156 -0.073 0.035 -0.017 -0.131 0.000 0.278 0.044 -0.025 -0.078 0.069 -0.110 -0.048 0.002 -0.103 0.124 -0.145 -0.178 -0.073 -0.018 0.040 0.196 -0.071 0.030 0.041 0.099 -0.082 -0.082 -0.059 0.011 0.123 -0.120 -0.088 -0.097 0.012 0.039 -0.023 -0.131 0.092 0.087 -0.103 0.025 -0.193 -0.036 -0.021 -0.012 -0.057 0.054 0.087 -0.085 0.019 -0.008 0.078 -0.015 0.285 -0.054 0.135 0.148 0.169 -0.089 -0.040 -0.049 -0.174 -0.207 -0.108 -0.052 -0.063 0.007 -0.068 0.012 0.037 -0.052 -0.050 -0.034 -0.068 0.181 -0.290 0.011 -0.049 0.068 0.041 0.059 -0.256 -0.065 -0.016 0.156 -0.128 -0.131 0.130 0.000 0.031 0.172 -0.007 0.108 0.084 -0.047 0.105 -0.076 0.061 0.100 0.082 0.131 -0.076 0.053 0.220 0.003 0.005 0.037 -0.298 -0.026 0.104 0.036 0.064 0.032 -0.029 -0.019 -0.068 -0.015 -0.070 -0.224 0.017 0.109 -0.083 -0.229 -0.124 0.043 0.020 -0.087 0.084 -0.157 0.255 0.126 0.041 0.054 0.053 -0.024 0.060 -0.046 -0.021 -0.073 0.014 -0.052 0.021 -0.015 0.020 0.010 0.066 0.050 0.106 0.061 0.003 0.146 -0.022 -0.020 0.019 0.052 0.101 -0.178 -0.013 -0.062 0.036 0.040 -0.118 0.047 0.065 0.272 0.002 -0.128 -0.117 0.055 0.023 0.033 -0.019 -0.023 -0.070 -0.125 -0.092 0.251 -0.070 -0.103 0.167 0.324 -0.095 0.028 0.025 0.085 -0.123 -0.078 -0.080 -0.009 0.042 0.202 0.063 -0.014 -0.073 0.343 -0.130 0.043 0.200 0.375 -0.092 -0.039 0.025 0.014 -0.137 0.012 0.018 0.010 -0.018 -0.046 0.327 0.043 -0.006 -0.074 0.067 0.046 -0.079 -0.036 -0.082 0.107 -0.064 0.089 0.042 0.010 0.001 -0.031 0.005 -0.013 0.186 -0.139 0.138 0.019 -0.046 -0.075 -0.105 -0.231 -0.141 -0.112 0.035 -0.001 0.031 -0.024 0.019 0.104 -0.099 0.117 0.031 0.029 -0.023 -0.147 0.192 0.065 0.233 0.090 -0.062 -0.207 -0.038 0.032 -0.018 0.013 -0.012 0.196 -0.069 0.061 0.113 -0.038 -0.056 -0.102 -0.191 0.008 -0.020 0.075 -0.095 -0.027 0.026 -0.061 -0.104 -0.009 0.074 0.058 -0.014 -0.001 0.283 -0.033 0.032 0.252 0.151 -0.271 0.094 -0.018 0.017 0.014 -0.014 -0.025 0.029 0.020 -0.058 -0.018 -0.025 0.022 -0.052 -0.026 0.048 -0.077 0.056 -0.010 -0.069 0.039 0.007 -0.014 -0.130 0.064 -0.017 0.001 0.004 -0.086 -0.084 -0.038 -0.034 -0.011 -0.008 0.102 0.156 -0.036 -0.012 0.011 -0.017 -0.013 -0.023 0.045 0.047 -0.092 0.090 -0.133 -0.018 -0.018 -0.109 0.051 0.059 -0.399 0.379 0.173 0.275 -0.342 -0.163 -0.001 -0.051 0.013 0.038 -0.110 -0.035 0.096 0.017 -0.053 -0.113 0.033 0.016 -0.006 0.056 -0.087 -0.031 0.009 0.034 0.052 0.042 0.050 -0.034 -0.111 0.060 0.184 0.035 -0.030 -0.082 -0.135 0.021 0.029 -0.002 -0.002 -0.166 -0.010 -0.063 -0.037 -0.000 0.009 -0.095 0.025 -0.046 0.014 0.033 0.032 -0.372 -0.148 -0.203 -0.023 -0.017 -0.031 0.004 -0.018 0.025 0.023 0.034 -0.005 -0.008 -0.140 0.066 0.003 -0.007 0.013 -0.009 0.022 0.019 -0.007 0.059 0.004 0.030 0.011 0.021 -0.067 0.095 -0.002 0.054 -0.009 -0.009 0.083 0.040 0.093 -0.084 -0.080 0.037 -0.018 0.076 0.029 -0.018 -0.023 -0.007 0.008 0.013 0.032 0.276 -0.275 -0.130 0.043 -0.054 0.005 0.000 0.102 -0.022 0.072 0.047 0.029 -0.014 -0.006 0.032 -0.024 0.004 0.040 0.578 -0.306 0.093 0.064 -0.055 -0.097 0.036 -0.010 -0.021 -0.027 0.003 -0.031 -0.031 -0.052 -0.003 -0.101 -0.029 -0.004 -0.033 -0.001 0.023 0.090 -0.095 -0.088 -0.019 -0.033 -0.013 -0.006 0.026 0.055 0.015 0.007 0.009 0.054 0.010 -0.002 0.010 -0.084 -0.008 -0.005 0.042 -0.018 -0.187 0.149 -0.069 -0.028 -0.048 -0.033 -0.080 0.148 0.089 0.067 0.021 -0.006 0.070 0.007 0.098 -0.081 -0.075 0.062 -0.172 0.154 0.063 0.036 -0.107 0.008 0.296 0.035 0.158 -0.070 0.318 0.028 -0.037 0.425 -0.157 -0.029 0.005 -0.089 0.026 0.080 -0.069 0.001 0.046 0.251 -0.021 0.018 0.070 -0.329 0.283 -0.071 -0.084 -0.061 0.095 -0.039 -0.002 -0.028 0.008 -0.021 -0.029 0.073 -0.028 0.021 -0.062 -0.045 0.005 -0.077 -0.007 0.030 0.021 -0.121 -0.117 0.008 0.046 -0.006 -0.116 -0.052 0.026 0.022 0.005 -0.013 -0.077 -0.508 0.167 -0.014 0.067 -0.002 -0.006 -0.032 0.073 0.460 -0.061 0.134 0.015 0.040 0.020 -0.027 -0.002 0.064 -0.001 -0.029 0.003 -0.053 -0.012 0.070 0.099 -0.039 -0.061 0.159 -0.059 -0.033 -0.007 0.073 -0.094 0.067 -0.065 0.021 -0.079 0.275 -0.015 0.064 0.039 -0.019 -0.003 0.108 -0.157 -0.014 -0.014 -0.033 -0.092 0.054 0.091 -0.114 -0.066 0.049 -0.257 0.233 -0.055 0.198 0.112 -0.175 -0.063 0.014 0.003 0.061 -0.035 -0.015 -0.154 0.005 -0.058 -0.006 0.072 -0.056 0.059 -0.028 -0.004 -0.020 0.106 0.075 0.025 -0.023 -0.020 0.066 0.083 0.019 -0.012 -0.006 0.013 -0.111 0.104 -0.065 -0.029 -0.003 0.061 -0.040 -0.053 0.021 0.447 -0.133 0.149 -0.064 -0.181 -0.086 -0.060 0.155 0.073 0.073 0.017 0.005 0.155 0.118 0.118 0.007 -0.055 0.028 0.153 -0.126 -0.077 0.044 0.005 -0.012 0.373 0.185 0.178 0.128 -0.048 -0.024 0.090 0.058 0.002 -0.009 -0.173 0.084 0.005 0.102 -0.126 -0.023 -0.099 -0.178 0.020 0.102 0.038 0.123 -0.081 0.021 0.079 0.164 -0.070 0.017 0.001 0.004 -0.248 0.057 0.033 -0.027 -0.017 0.017 -0.308 0.135 -0.179 0.038 0.122 -0.013 0.219 0.032 0.093 0.036 -0.067 -0.019 0.206 0.083 -0.086 -0.043 -0.001 0.004 0.016 -0.276 0.152 0.001 -0.034 0.016 -0.051 -0.084 -0.029 0.111 0.073 0.062 0.047 0.094 -0.036 0.069 -0.067 -0.112 0.036 0.010 0.015 -0.002 -0.156 -0.198 -0.089 0.079 0.037 0.026 -0.062 -0.016 0.008 -0.068 -0.041 -0.150 -0.001 -0.034 -0.070 -0.151 0.089 0.112 0.203 -0.119 -0.020 -0.020 0.160 0.059 -0.027 0.101 -0.050 -0.022 0.080 0.247 0.072 -0.121 -0.066 -0.223 0.200 0.060 -0.035 0.056 0.004 -0.013 -0.028 -0.120 0.060 0.069 -0.102 -0.013 -0.033 0.323 -0.175 0.163 0.047 0.105 -0.007 0.188 0.048 0.050 -0.056 0.106 0.041 -0.233 0.014 0.032 0.048 -0.047 0.023 0.057 -0.222 0.067 -0.001 -0.017 -0.055 0.087 0.183 0.051 -0.021 0.048 -0.027 0.006 -0.023 -0.073 -0.104 0.139 -0.012 -0.166 0.024 -0.064 0.150 -0.188 -0.101 0.092 -0.028 -0.032 0.061 -0.056 -0.046 0.011 0.014 0.015 0.002 0.016 0.011 0.045 -0.212 0.044 -0.127 -0.019 -0.001 -0.061 -0.094 0.149 -0.121 0.036 -0.196 -0.031 0.064 0.219 -0.224 -0.017 0.107 0.128 -0.279 0.194 0.017 -0.212 -0.224 0.002 -0.006 -0.013 -0.042 0.001 0.005 0.014 -0.012 0.036 0.159 -0.095 0.096 -0.023 0.007 0.011 -0.048 -0.017 0.046 -0.064 0.036 -0.019 0.446 0.204 -0.105 -0.036 0.015 0.010 0.010 -0.038 -0.004 -0.000 -0.001 -0.019 0.043 0.115 0.053 -0.011 0.003 -0.020 0.010 0.021 0.020 0.111 -0.135 -0.103 0.045 0.062 0.191 -0.074 0.003 -0.024 0.099 -0.249 -0.056 0.079 -0.102 -0.081 0.003 0.015 0.016 0.106 0.121 0.073 -0.005 -0.001 0.005 -0.060 -0.033 0.019 0.028 0.053 -0.047 -0.114 -0.042 0.057 -0.002 0.023 0.070 0.503 0.173 -0.187 0.020 0.002 0.014 0.235 -0.222 -0.475 -0.024 0.007 -0.005 0.030 0.020 -0.007 0.026 -0.002 -0.032 0.034 -0.016 0.031 0.029 0.009 -0.003 -0.022 0.030 0.013 0.039 -0.019 -0.022 -0.042 -0.306 0.245 -0.008 0.054 0.051 0.006 -0.024 0.029 -0.005 0.004 0.002 0.005 0.002 -0.016 0.090 -0.050 0.016 -0.015 0.009 0.059 -0.061 0.045 0.055 0.227 -0.055 0.158 -0.047 -0.070 -0.095 0.012 -0.080 0.023 -0.139 0.168 0.058 -0.002 0.019 -0.018 -0.248 -0.162 -0.156 -0.051 -0.027 0.047 0.029 -0.020 -0.006 0.002 -0.007 0.025 -0.193 0.106 -0.189 -0.015 0.005 -0.018 -0.199 -0.136 0.197 -0.106 -0.053 0.055 -0.048 0.059 0.082 -0.013 0.040 -0.014 0.286 0.087 0.185 -0.010 0.008 -0.026 -0.091 -0.148 0.254 0.024 0.038 0.032 -0.177 0.009 -0.022 0.015 -0.038 -0.004 -0.004 0.024 -0.016 -0.003 0.000 -0.015 -0.078 -0.079 -0.110 0.024 -0.023 -0.001 0.008 -0.007 -0.046 0.087 -0.304 -0.102 -0.049 -0.130 0.181 0.009 0.011 0.065 0.044 -0.009 -0.037 -0.292 -0.194 -0.316 -0.041 0.018 0.033 -0.080 0.059 0.029 0.007 0.003 -0.022 0.148 0.056 0.042 -0.036 -0.229 0.182 -0.137 0.192 0.018 0.083 0.095 -0.158 0.111 0.020 0.049 0.109 0.100 0.032 -0.006 0.014 -0.006 0.154 -0.102 0.101 0.039 0.060 -0.026 -0.003 0.029 -0.008 0.095 0.033 0.133 0.007 -0.025 0.027 -0.069 -0.092 0.160 -0.084 0.003 -0.016 0.107 0.002 0.089 0.013 -0.023 -0.005 0.035 -0.005 -0.012 -0.007 -0.000 0.002 -0.050 -0.063 -0.069 0.020 -0.007 -0.002 0.006 -0.011 -0.029 0.028 -0.191 -0.074 0.076 0.119 -0.188 -0.005 -0.015 -0.030 0.042 -0.010 0.035 0.224 0.033 0.221 -0.002 0.013 -0.004 -0.048 0.043 0.027 0.002 0.007 -0.020 -0.149 0.057 -0.064 0.137 -0.067 -0.136 -0.091 0.098 0.025 -0.083 -0.056 -0.028 -0.006 -0.035 0.039 0.062 0.059 0.020 -0.001 0.044 -0.043 0.639 0.239 -0.310 -0.037 -0.073 0.012 -0.011 -0.048 0.011 0.206 0.030 0.274 0.012 -0.054 -0.009 0.052 0.140 -0.246 -0.022 0.006 0.008 -0.108 0.064 0.218 -0.014 0.025 0.004 -0.071 -0.083 0.062 0.015 0.022 -0.004 0.020 -0.013 -0.005 0.010 0.010 -0.021 -0.037 -0.084 0.018 -0.023 0.272 0.112 0.040 -0.028 -0.090 0.022 -0.047 0.014 -0.012 -0.000 0.004 -0.097 0.048 -0.027 0.041 -0.018 -0.035 0.061 -0.029 -0.010 0.006 -0.006 -0.002 -0.022 0.260 -0.106 0.049 -0.124 0.046 -0.022 0.156 -0.055 0.049 -0.067 -0.175 -0.047 -0.007 -0.008 -0.045 -0.027 0.051 -0.206 0.037 0.052 0.528 0.208 -0.182 -0.054 -0.069 0.036 0.043 0.051 -0.010 -0.275 -0.040 -0.014 0.021 -0.087 -0.026 -0.063 -0.140 0.239 0.026 -0.016 0.017 -0.132 0.089 0.287 0.004 -0.014 0.004 -0.075 -0.047 0.061 0.015 0.016 -0.001 0.204 0.107 0.315 -0.124 -0.034 -0.016 0.010 0.065 -0.003 0.020 -0.251 -0.114 0.039 -0.013 -0.085 0.043 -0.076 -0.009 -0.047 -0.013 -0.083 -0.102 0.133 -0.008 -0.020 0.058 -0.009 0.013 0.011 0.027 -0.050 -0.035 0.019 0.020 0.344 -0.122 -0.013 0.085 0.052 0.305 -0.090 -0.224 0.056 -0.088 -0.069 0.016 0.040 -0.009 -0.105 0.073 -0.035 -0.193 0.053 0.051 -0.081 0.078 0.021 -0.046 -0.048 0.033 -0.048 -0.011 -0.004 -0.273 -0.100 -0.181 -0.019 -0.063 0.008 0.140 0.011 -0.032 0.041 -0.021 0.050 0.074 0.001 0.134 0.062 -0.031 -0.004 -0.010 0.033 0.003 -0.003 -0.007 0.012 -0.155 -0.075 -0.216 0.076 0.020 0.022 0.177 0.305 -0.074 0.125 0.036 0.072 0.091 0.157 -0.225 0.062 -0.049 -0.023 -0.031 -0.025 -0.164 -0.209 0.126 -0.041 -0.169 -0.008 0.222 -0.261 0.052 -0.050 0.030 0.033 -0.015 -0.090 0.168 -0.055 0.017 0.066 0.040 -0.199 -0.013 0.186 0.129 0.074 -0.134 0.155 0.145 -0.059 0.055 -0.110 0.014 0.012 0.012 0.019 -0.079 -0.027 0.125 0.045 0.042 -0.014 -0.005 -0.010 0.000 0.283 0.025 -0.029 -0.031 0.013 0.038 0.068 0.004 -0.015 -0.001 -0.030 0.037 0.151 -0.084 -0.115 0.023 0.019 -0.000 0.075 0.116 -0.062 -0.010 -0.033 0.014 0.122 0.124 0.173 -0.076 -0.009 -0.010 0.025 0.056 0.028 0.045 0.034 0.030 0.045 0.169 -0.140 -0.092 0.148 -0.003 -0.034 0.020 -0.049 -0.110 -0.050 -0.033 -0.061 -0.066 0.128 -0.085 -0.051 -0.086 -0.043 -0.009 0.009 -0.129 -0.117 0.048 0.065 -0.093 0.029 0.193 -0.035 -0.143 0.057 0.168 -0.167 0.073 0.079 -0.099 -0.053 0.044 -0.030 0.190 0.024 -0.071 0.511 0.257 -0.239 -0.022 -0.226 -0.058 0.030 0.018 0.011 -0.027 -0.052 -0.142 -0.098 -0.002 0.029 -0.145 0.013 0.026 0.036 -0.022 0.054 0.240 -0.069 -0.079 -0.032 -0.033 0.029 -0.035 -0.026 0.039 0.027 0.042 0.021 -0.070 0.012 -0.086 0.028 -0.009 0.024 -0.150 -0.273 -0.095 -0.071 -0.087 -0.055 0.027 0.155 -0.233 0.061 -0.042 -0.147 -0.173 -0.012 -0.113 -0.183 0.039 -0.057 0.146 0.218 -0.247 0.215 0.021 0.150 0.022 -0.026 -0.015 0.060 -0.002 0.135 0.063 -0.045 0.040 -0.053 0.005 0.062 0.114 0.163 -0.158 -0.304 -0.043 -0.122 0.024 -0.016 -0.056 -0.021 -0.049 0.126 0.219 0.018 0.036 -0.099 -0.323 -0.026 -0.007 -0.001 0.017 0.041 0.024 0.215 0.041 0.040 0.010 0.037 0.038 -0.019 -0.034 0.001 -0.053 -0.101 -0.005 -0.067 0.071 -0.028 0.030 0.113 0.182 -0.042 0.012 0.015 0.039 -0.009 -0.055 0.045 -0.014 0.006 0.004 0.041 0.009 -0.202 0.047 -0.039 0.025 -0.035 -0.110 0.156 0.141 -0.093 -0.073 -0.341 0.006 -0.345 0.122 0.025 0.054 -0.072 0.120 0.137 -0.179 -0.043 -0.041 0.012 -0.039 -0.134 0.020 -0.065 0.019 -0.042 -0.014 -0.043 0.057 0.102 -0.055 -0.052 -0.078 0.118 -0.171 0.095 -0.240 -0.006 -0.012 -0.058 0.333 -0.028 -0.005 0.015 0.070 -0.139 -0.117 -0.075 0.042 -0.021 -0.013 -0.009 0.038 -0.006 0.156 -0.092 0.064 0.002 0.117 -0.019 -0.010 -0.006 -0.014 -0.015 0.219 0.003 -0.141 -0.005 -0.058 -0.020 -0.099 -0.189 0.047 0.001 0.048 -0.022 0.081 0.041 0.087 -0.041 -0.001 -0.023 0.170 0.307 0.025 0.105 0.050 0.052 -0.069 -0.037 -0.071 0.327 -0.383 -0.001 0.141 -0.055 0.045 0.011 0.054 0.015 -0.053 0.082 -0.054 -0.004 0.128 0.107 -0.041 0.018 0.040 0.126 -0.149 0.156 0.033 -0.082 -0.009 0.067 0.018 -0.085 0.029 -0.037 0.039 0.058 -0.029 0.210 -0.032 0.018 0.048 -0.110 -0.199 0.164 0.278 0.070 -0.098 -0.012 0.035 0.027 0.006 0.014 0.041 -0.007 -0.002 -0.054 -0.027 -0.001 -0.006 0.241 0.031 0.047 0.002 0.004 0.012 0.059 0.008 0.001 -0.011 0.059 0.002 -0.070 -0.097 0.030 0.004 0.004 -0.016 -0.169 -0.173 0.053 -0.024 0.027 0.077 -0.007 -0.029 -0.057 -0.278 -0.058 -0.065 -0.009 0.014 -0.041 0.037 -0.073 0.021 0.063 0.031 0.114 -0.016 -0.015 -0.009 0.015 -0.146 0.063 -0.065 -0.051 -0.087 0.139 -0.246 -0.640 0.032 -0.001 0.021 0.018 -0.008 0.006 0.188 0.163 -0.030 0.009 0.006 -0.016 0.022 -0.043 0.089 0.066 -0.088 -0.285 -0.136 -0.041 0.047 0.017 -0.033 0.043 -0.073 -0.086 0.035 0.031 0.022 -0.009 -0.128 -0.050 0.135 -0.052 0.029 -0.002 -0.236 -0.019 0.030 0.028 -0.026 -0.013 0.116 0.006 -0.062 0.058 0.143 -0.001 -0.110 -0.151 0.063 0.007 0.019 -0.011 0.033 0.024 -0.041 0.021 -0.010 -0.023 -0.157 -0.330 0.007 -0.013 -0.076 -0.050 -0.024 -0.027 -0.075 0.151 -0.181 0.042 0.007 0.092 0.052 -0.042 0.123 0.001 -0.031 -0.347 0.307 -0.193 -0.257 -0.335 -0.019 0.064 0.184 0.016 -0.084 0.052 -0.005 -0.025 0.008 -0.087 -0.005 0.017 0.042 -0.019 0.019 0.026 0.004 -0.003 -0.039 0.043 0.069 -0.136 -0.139 0.126 0.087 0.052 -0.054 0.044 0.071 -0.016 0.006 0.006 -0.001 -0.256 -0.117 0.426 0.005 0.041 0.023 0.047 -0.033 0.043 0.091 -0.095 -0.047 -0.016 -0.035 -0.102 -0.035 -0.012 0.003 0.045 0.056 -0.039 -0.013 -0.026 0.004 -0.010 -0.073 -0.012 0.015 0.024 -0.017 -0.031 0.041 0.045 -0.030 -0.023 -0.020 0.024 -0.071 -0.038 -0.098 0.173 0.026 0.043 0.004 0.032 -0.122 0.323 -0.003 0.034 0.034 -0.089 0.107 0.026 0.060 -0.012 0.013 -0.089 -0.130 -0.124 -0.004 -0.092 -0.022 0.041 -0.031 0.130 -0.023 0.073 0.035 0.015 0.061 0.050 -0.039 -0.055 -0.005 0.014 0.097 0.022 -0.067 0.228 0.399 -0.403 0.099 0.103 -0.007 0.000 -0.008 0.010 -0.040 -0.008 0.063 0.007 0.007 0.022 -0.039 0.031 -0.042 0.029 -0.027 -0.004 -0.031 -0.029 -0.018 0.048 0.011 -0.013 -0.082 -0.090 -0.009 0.016 -0.003 -0.005 0.023 -0.008 0.028 -0.013 0.014 -0.013 0.169 0.112 -0.274 0.087 -0.013 0.038 -0.008 -0.007 0.036 -0.209 0.156 -0.347 -0.129 -0.000 0.154 -0.029 0.039 -0.007 -0.020 -0.024 0.069 -0.203 0.023 -0.044 -0.009 0.024 0.035 0.145 0.077 0.061 -0.029 -0.012 0.010 0.013 -0.020 -0.012 -0.001 0.081 -0.009 -0.348 -0.369 0.272 0.028 0.020 0.004 -0.294 0.106 -0.016 0.120 0.162 -0.161 -0.040 -0.000 0.032 0.044 -0.023 0.035 0.008 -0.007 -0.014 -0.009 -0.002 -0.012 -0.075 0.058 -0.048 -0.001 0.010 0.005 0.017 0.012 0.003 -0.124 0.053 0.057 0.043 0.050 -0.017 0.007 -0.014 -0.021 0.011 0.036 0.010 -0.008 -0.004 -0.003 -0.005 0.088 -0.768 0.187 -0.070 0.059 0.009 -0.024 -0.060 0.040 0.001 0.298 0.031 0.065 0.116 -0.005 0.001 -0.002 0.128 -0.105 -0.108 -0.054 0.060 0.057 -0.045 -0.026 0.065 -0.112 -0.064 -0.044 0.022 0.011 0.005 0.007 -0.000 -0.019 -0.004 -0.051 -0.023 0.087 0.104 -0.001 0.029 -0.043 -0.002 0.124 -0.018 -0.052 -0.148 -0.168 0.174 0.000 -0.001 0.000 -0.001 0.002 -0.001 0.029 -0.012 0.066 0.004 0.007 0.008 0.006 -0.004 0.004 -0.005 0.000 0.000 0.003 -0.006 -0.008 0.006 -0.002 -0.003 0.005 0.001 -0.008 0.001 0.000 -0.000 0.004 0.008 0.000 -0.003 -0.004 -0.000 0.003 0.005 0.019 0.001 -0.002 -0.000 0.010 0.003 -0.056 -0.008 0.021 0.007 -0.009 0.003 0.002 -0.018 0.030 0.007 -0.004 0.004 0.004 -0.002 -0.004 -0.003 -0.011 -0.006 -0.003 -0.018 -0.011 -0.001 0.049 0.003 -0.041 0.004 0.019 -0.010 0.009 -0.021 -0.037 -0.021 -0.021 0.013 -0.006 0.003 0.000 0.001 0.008 -0.013 -0.554 -0.617 0.540 -0.057 -0.081 0.029 -0.012 0.006 -0.006 -0.054 0.013 -0.070 -0.029 -0.002 -0.020 -0.003 -0.004 0.000 0.024 0.012 0.017 0.017 0.016 0.004 0.052 -0.028 -0.024 0.137 0.085 -0.096 0.031 0.034 -0.028 -0.001 -0.017 0.006 -0.004 0.006 -0.001 0.079 0.004 0.117 -0.031 0.011 -0.009 -0.016 -0.155 -0.136 -0.034 0.100 0.577 -0.102 0.024 0.005 -0.009 -0.013 -0.021 -0.037 0.044 0.029 -0.033 -0.017 -0.018 0.047 0.003 0.004 -0.135 -0.071 -0.033 0.008 0.024 0.098 0.001 -0.027 0.011 -0.056 -0.099 -0.066 -0.251 -0.257 0.162 0.011 0.003 0.002 0.214 0.044 -0.165 0.319 0.312 -0.160 0.015 0.019 -0.008 -0.001 0.010 -0.004 -0.023 0.018 -0.128 0.055 0.095 0.076 -0.019 -0.002 0.015 -0.023 0.057 0.018 -0.076 -0.032 -0.094 -0.008 0.001 0.004 -0.034 -0.044 -0.014 -0.022 -0.018 0.015 -0.011 -0.011 0.007 -0.010 0.009 -0.002 -0.013 0.022 -0.012 -0.014 -0.013 -0.017 0.076 -0.489 -0.306 0.076 0.047 -0.266 0.028 0.028 0.004 -0.003 -0.033 -0.028 0.008 -0.005 -0.002 0.010 -0.004 -0.003 0.163 -0.072 0.061 -0.086 -0.058 0.006 0.108 0.095 0.264 -0.006 -0.030 0.004 -0.039 -0.279 -0.207 0.040 0.049 -0.025 -0.038 -0.116 0.025 -0.096 0.011 0.005 0.370 0.267 0.138 0.011 0.007 -0.006 -0.016 0.028 -0.012 0.070 0.028 0.100 -0.008 -0.014 -0.012 -0.112 0.020 0.017 0.004 -0.033 -0.006 0.029 0.008 0.015 -0.012 0.003 0.004 0.018 0.020 -0.020 0.001 0.003 0.000 -0.021 -0.099 0.060 -0.058 0.080 -0.041 0.097 0.001 -0.029 -0.089 -0.017 -0.065 -0.083 0.171 0.087 -0.040 -0.015 0.049 0.007 -0.077 -0.002 -0.011 0.011 0.010 -0.001 0.007 0.001 -0.022 0.037 0.012 0.760 -0.217 0.242 0.041 0.008 0.015 -0.018 -0.043 -0.082 -0.015 -0.106 0.004 0.053 -0.004 0.001 0.022 0.018 -0.025 -0.084 -0.324 0.087 0.054 -0.015 -0.010 -0.078 -0.145 0.040 0.007 0.008 -0.002 0.002 -0.003 0.002 -0.135 0.040 -0.029 0.028 0.034 0.028 0.005 0.001 -0.004 -0.015 0.003 -0.013 0.037 0.008 -0.029 0.001 0.002 -0.001 0.010 0.010 -0.002 -0.001 -0.003 0.000 0.002 -0.005 -0.003 0.008 -0.007 0.005 0.000 -0.011 0.002 0.003 0.003 0.005 -0.360 0.331 0.167 -0.050 0.063 0.006 -0.018 -0.023 0.013 0.004 -0.010 -0.025 -0.001 0.000 0.000 -0.002 0.005 0.002 -0.077 0.039 -0.032 0.055 -0.056 0.040 0.059 -0.033 0.027 0.002 0.001 0.005 0.261 -0.531 -0.272 -0.001 0.003 -0.005 0.028 0.039 -0.008 -0.030 0.055 -0.054 0.467 0.029 0.155 -0.053 -0.034 0.025 0.020 0.016 -0.003 0.096 -0.087 -0.022 -0.007 -0.008 -0.004 0.017 -0.034 0.041 -0.020 0.026 -0.000 -0.012 -0.007 -0.009 0.013 -0.044 -0.006 -0.021 0.023 0.269 -0.007 -0.015 -0.010 -0.030 0.035 -0.028 0.035 -0.022 0.015 -0.170 0.212 -0.014 0.010 -0.039 -0.010 0.074 0.077 0.098 0.088 0.126 -0.017 0.133 0.552 -0.155 0.006 -0.014 -0.001 0.019 0.002 -0.009 0.046 -0.110 -0.030 -0.016 0.006 -0.006 -0.032 -0.054 -0.046 -0.045 -0.006 -0.053 -0.032 0.034 -0.007 0.109 -0.029 0.015 -0.073 -0.146 0.080 -0.385 -0.249 0.005 -0.220 0.234 0.057 0.056 0.095 -0.144 0.019 0.014 -0.000 0.029 0.013 0.002 0.096 -0.066 -0.022 0.002 0.002 -0.001 -0.036 -0.050 0.006 -0.002 0.031 0.010 -0.002 -0.004 0.003 0.026 0.009 -0.014 -0.019 -0.071 -0.238 0.018 0.007 -0.004 -0.027 0.020 -0.049 0.056 -0.065 0.035 -0.021 0.085 -0.001 -0.045 -0.046 0.007 0.001 -0.015 0.004 0.008 -0.013 0.022 -0.293 -0.314 0.319 0.002 -0.016 -0.003 -0.037 -0.011 -0.005 -0.011 0.066 0.010 0.027 0.215 -0.073 0.014 0.016 0.005 -0.053 -0.010 -0.060 -0.039 0.037 0.017 0.025 -0.012 0.003 0.007 0.183 0.017 -0.661 -0.093 -0.107 0.042 -0.147 -0.079 0.113 0.035 -0.032 -0.005 0.012 0.000 0.000 0.013 -0.005 0.038 -0.055 -0.003 0.030 0.016 0.021 0.026 -0.008 0.015 0.068 0.056 0.119 -0.004 0.010 -0.010 0.017 -0.009 -0.008 0.008 0.057 0.121 0.006 -0.002 -0.016 -0.000 0.027 0.010 -0.011 0.023 -0.011 -0.075 0.003 0.024 0.026 -0.009 0.004 -0.153 -0.156 -0.157 -0.042 -0.050 -0.023 -0.106 -0.026 0.101 -0.021 -0.032 -0.010 -0.009 -0.002 -0.001 0.002 0.006 0.002 -0.145 -0.146 0.022 -0.017 -0.002 0.014 -0.444 -0.080 -0.590 0.009 0.012 -0.017 -0.003 -0.076 -0.081 0.023 0.043 -0.008 0.150 -0.180 0.092 0.059 0.010 0.055 0.358 -0.046 -0.179 0.003 -0.034 -0.003 0.003 0.017 -0.006 0.024 -0.085 -0.009 -0.016 -0.010 -0.017 0.034 -0.009 0.022 -0.031 0.014 -0.006 -0.024 -0.008 -0.005 0.012 -0.002 -0.003 -0.072 -0.282 -0.561 -0.007 0.008 0.049 -0.004 0.032 0.014 -0.011 0.035 -0.015 -0.122 0.031 0.017 0.034 -0.011 0.002 0.170 0.049 0.108 0.193 0.193 0.033 0.011 0.047 0.023 0.006 -0.000 0.000 0.001 -0.005 -0.002 0.011 -0.018 -0.002 -0.176 -0.186 0.030 0.007 0.021 0.007 -0.018 0.008 -0.019 0.006 0.013 -0.029 0.151 -0.032 0.030 -0.050 0.021 0.003 0.172 -0.256 0.122 -0.296 -0.063 -0.318 -0.075 0.088 -0.169 -0.014 0.008 0.031 -0.005 0.014 -0.007 0.002 -0.022 0.003 -0.021 -0.002 -0.003 0.040 0.007 0.030 -0.032 -0.016 -0.053 0.009 -0.010 0.003 0.047 -0.059 -0.034 0.006 0.123 0.325 0.025 -0.007 -0.056 -0.011 0.017 0.022 -0.010 0.043 -0.017 -0.157 0.018 0.057 0.041 -0.001 -0.007 0.087 0.063 0.077 0.003 -0.028 -0.010 -0.447 0.063 0.466 0.006 0.010 0.009 -0.020 0.005 0.001 0.025 0.047 -0.023 -0.142 -0.177 0.035 -0.009 -0.042 -0.052 0.179 0.035 0.248 -0.001 -0.001 -0.029 0.034 0.035 0.047 0.034 0.208 0.014 0.210 -0.243 0.128 0.038 0.082 0.193 -0.102 0.063 0.044 -0.023 -0.024 0.017 -0.026 -0.035 0.006 -0.052 0.027 -0.006 -0.011 -0.003 -0.004 -0.001 0.050 0.000 0.001 -0.000 0.030 -0.015 0.010 -0.016 -0.000 -0.069 -0.015 -0.042 -0.106 -0.081 -0.000 -0.005 0.003 0.021 -0.029 -0.014 -0.005 -0.020 0.006 0.051 -0.016 0.002 0.007 0.038 -0.024 0.115 -0.009 0.026 0.182 0.127 -0.013 -0.200 0.367 0.251 0.005 0.007 -0.013 0.016 0.020 0.009 0.029 0.020 -0.036 0.275 0.005 0.057 -0.023 -0.009 0.005 -0.097 -0.012 -0.147 0.010 -0.011 0.031 0.056 -0.058 -0.032 0.054 0.113 -0.053 0.054 0.493 -0.156 -0.354 0.219 -0.142 -0.144 -0.009 -0.176 0.008 0.002 0.000 -0.001 -0.001 0.000 -0.001 -0.010 -0.002 -0.004 0.002 -0.003 0.001 0.001 -0.000 -0.003 0.002 0.002 -0.006 -0.008 0.003 0.000 0.002 -0.000 -0.041 0.020 0.012 -0.002 -0.003 -0.004 0.001 0.000 -0.001 0.000 0.000 0.000 0.003 -0.004 0.002 0.001 0.000 0.000 0.044 0.004 0.021 0.032 0.039 -0.009 0.015 -0.006 0.005 0.001 0.001 -0.001 0.000 -0.000 0.001 0.001 0.003 -0.004 0.005 -0.011 0.005 -0.015 0.025 0.008 -0.008 0.001 -0.011 0.001 0.001 0.001 0.019 -0.023 -0.010 -0.022 -0.000 0.024 0.001 0.018 -0.006 0.632 -0.694 0.325 -0.029 0.010 -0.037 -0.027 0.002 -0.026 0.004 0.000 0.001 -0.003 0.112 0.014 0.049 -0.020 -0.001 -0.002 0.008 0.007 0.026 -0.023 -0.010 0.001 0.024 0.005 0.006 -0.035 -0.007 -0.066 -0.087 -0.157 0.006 0.013 0.020 -0.009 -0.009 0.011 -0.003 -0.003 -0.000 -0.042 0.042 -0.007 -0.001 0.003 -0.010 -0.323 0.010 -0.117 -0.074 -0.063 0.001 -0.052 0.261 0.086 -0.009 -0.006 0.012 0.003 0.006 -0.006 0.004 -0.026 0.011 -0.002 0.103 -0.037 -0.002 0.057 0.060 0.047 -0.006 0.061 -0.005 -0.011 -0.005 -0.174 0.108 0.024 0.094 -0.053 -0.111 0.015 -0.093 0.036 0.410 -0.588 0.122 0.182 -0.082 0.249 0.005 0.002 0.001 -0.007 -0.006 0.000 0.007 -0.097 -0.010 0.044 -0.025 -0.001 0.023 0.002 0.008 -0.074 0.026 -0.025 -0.007 -0.009 0.014 0.007 0.008 -0.001 -0.004 0.010 0.014 -0.000 -0.004 -0.003 -0.004 0.011 -0.009 0.026 0.019 -0.001 -0.065 0.036 -0.001 0.023 0.001 0.001 -0.312 -0.118 -0.200 -0.017 0.061 0.026 0.016 -0.054 -0.021 0.016 -0.009 -0.002 -0.006 -0.005 -0.004 -0.001 -0.005 0.005 -0.011 -0.276 0.098 0.010 0.002 -0.028 0.017 0.009 0.040 -0.005 0.011 -0.002 0.441 0.184 0.296 -0.034 0.006 0.034 -0.070 0.185 -0.078 0.091 -0.078 0.006 0.463 -0.043 0.359 0.023 -0.016 0.026 0.007 0.013 -0.002 0.015 0.023 -0.002 0.002 -0.011 -0.005 -0.058 -0.013 -0.035 -0.065 0.008 0.004 -0.012 -0.009 0.000 -0.033 -0.012 0.007 -0.002 0.017 0.076 -0.011 -0.008 -0.008 0.046 -0.012 -0.009 -0.080 -0.058 0.006 0.303 -0.176 0.014 -0.060 -0.004 0.013 -0.012 -0.106 -0.093 0.128 0.146 0.005 -0.022 0.052 0.046 0.026 0.007 -0.028 0.027 0.020 0.026 0.011 0.052 -0.051 0.088 0.601 -0.200 -0.010 -0.011 -0.023 -0.033 -0.003 -0.057 0.035 0.001 0.019 0.412 0.062 0.180 0.001 0.028 -0.002 0.213 -0.272 0.135 -0.037 0.069 0.020 0.044 -0.032 0.022 0.017 -0.014 -0.007 -0.002 0.023 -0.006 0.021 -0.180 -0.007 -0.039 0.037 0.017 -0.012 -0.084 -0.060 -0.024 0.031 -0.004 0.022 -0.062 0.032 -0.033 -0.021 0.004 0.012 -0.010 -0.051 -0.001 0.050 0.018 0.011 0.014 -0.016 0.013 0.015 -0.002 0.369 -0.143 0.000 -0.030 -0.038 0.080 0.200 -0.038 0.060 -0.315 -0.221 0.020 -0.078 0.148 0.102 0.003 0.000 -0.002 0.020 0.022 0.010 -0.018 -0.009 0.026 -0.118 -0.160 0.032 0.074 -0.037 -0.128 -0.014 0.014 0.002 0.007 0.017 0.007 0.170 -0.070 0.008 0.295 -0.347 -0.324 -0.102 -0.009 -0.022 0.164 -0.237 0.168 0.053 0.046 -0.009 -0.024 0.017 -0.032 0.004 -0.037 0.011 -0.014 0.027 -0.006 -0.034 0.033 0.021 0.015 0.133 0.096 -0.030 0.002 0.010 0.019 -0.055 0.028 0.054 0.015 -0.017 0.013 -0.000 -0.075 0.016 0.023 0.009 0.020 -0.012 -0.007 -0.036 -0.031 0.005 -0.529 0.279 -0.037 0.048 0.058 -0.133 0.173 -0.069 0.010 -0.313 -0.213 0.023 -0.012 -0.065 -0.015 0.020 0.013 -0.028 -0.052 -0.033 -0.054 -0.031 -0.104 0.123 0.198 0.250 -0.047 0.077 -0.038 -0.143 -0.019 -0.001 -0.037 0.012 -0.003 0.013 0.225 -0.051 0.031 0.065 -0.137 -0.070 0.164 0.055 0.018 0.139 -0.198 0.093 -0.130 0.017 -0.129 -0.179 0.101 -0.130 -0.003 0.005 -0.003 0.017 -0.162 0.003 -0.015 0.022 0.039 -0.005 -0.017 -0.015 0.001 0.019 -0.006 0.018 -0.022 0.011 -0.012 -0.028 0.008 -0.007 -0.023 -0.150 0.049 -0.036 0.008 0.024 0.000 -0.020 -0.012 -0.001 -0.001 0.116 -0.091 0.024 -0.012 -0.008 0.025 0.027 -0.003 0.014 -0.332 -0.247 0.014 0.083 0.222 -0.091 -0.003 -0.002 0.005 0.024 0.013 0.028 0.038 0.078 -0.117 0.006 0.012 -0.003 0.111 -0.044 -0.213 -0.016 0.020 0.013 0.015 0.012 0.021 -0.001 -0.004 -0.005 -0.260 0.454 0.261 0.020 0.003 0.003 0.096 -0.219 0.009 0.278 -0.025 0.243 0.017 -0.010 0.013 -0.001 -0.004 0.001 0.033 -0.297 0.009 0.004 -0.006 -0.007 -0.001 0.020 0.013 0.009 0.031 -0.019 -0.002 0.005 -0.002 0.003 0.003 -0.001 -0.000 0.001 0.014 -0.005 0.002 -0.001 0.050 -0.004 -0.041 -0.025 -0.005 -0.002 -0.028 0.014 -0.003 0.005 0.008 -0.019 -0.007 0.037 0.042 0.042 0.027 -0.002 -0.007 -0.021 0.007 -0.016 -0.013 0.026 -0.003 -0.002 -0.003 -0.004 -0.009 0.013 0.046 0.051 -0.009 -0.016 0.007 0.034 -0.036 0.049 0.032 0.031 0.022 0.047 -0.093 0.012 -0.011 0.018 -0.034 -0.018 0.048 0.020 0.002 -0.012 0.025 -0.007 0.676 -0.088 0.632 -0.049 0.026 -0.036 0.000 0.001 0.000 -0.011 0.125 -0.005 0.013 0.016 -0.064 0.000 -0.009 -0.007 -0.013 -0.027 -0.002 0.001 -0.095 0.067 0.000 -0.003 0.001 -0.003 -0.005 0.004 0.010 -0.002 0.001 -0.035 0.007 0.030 0.012 0.001 0.001 0.004 -0.003 0.001 -0.002 -0.002 0.006 0.126 -0.023 0.043 -0.093 -0.066 -0.001 0.003 0.024 -0.005 0.031 0.022 -0.042 -0.001 -0.000 -0.001 0.003 0.006 -0.009 -0.011 -0.010 0.001 -0.150 0.050 0.307 -0.060 0.055 -0.011 -0.018 -0.013 -0.031 0.068 -0.024 0.016 -0.015 0.029 0.013 -0.011 -0.006 0.000 -0.064 0.098 -0.019 0.599 -0.135 0.631 -0.028 0.014 -0.021 0.000 -0.002 -0.001 0.011 -0.131 0.004 0.021 0.013 -0.032 -0.001 0.017 0.013 0.003 0.033 -0.003 0.000 -0.078 0.053 0.000 -0.001 0.000 -0.002 -0.003 0.003 0.005 -0.001 0.001 0.044 -0.010 -0.038 -0.014 -0.000 0.000 -0.001 -0.001 0.001 -0.001 0.001 0.001 -0.051 -0.004 -0.017 -0.042 -0.032 -0.003 0.001 0.010 -0.002 -0.043 -0.033 0.061 -0.001 -0.000 -0.001 0.001 0.002 -0.004 0.009 0.007 -0.001 -0.076 0.025 0.158 0.061 -0.054 0.011 0.020 0.014 0.034 0.016 -0.019 -0.001 -0.006 0.012 0.005 0.009 0.004 0.000 -0.031 0.049 -0.013 -0.653 0.147 -0.679 -0.004 0.002 -0.002 -0.021 0.034 0.097 0.002 -0.023 0.001 0.002 0.001 -0.003 0.015 -0.551 -0.458 0.001 0.005 -0.001 0.000 -0.009 0.006 -0.001 0.003 -0.015 -0.001 -0.000 -0.000 0.001 -0.001 -0.000 -0.023 0.010 0.022 -0.000 -0.004 -0.008 -0.015 -0.001 -0.001 0.213 0.161 -0.616 -0.008 0.000 -0.002 -0.003 -0.002 -0.000 -0.001 0.005 0.003 -0.006 -0.005 0.009 0.025 0.011 0.029 -0.014 -0.038 0.057 0.013 0.007 -0.004 -0.006 0.002 0.013 0.008 -0.007 0.002 0.012 0.008 0.026 0.000 -0.002 -0.000 -0.006 0.019 0.007 0.019 -0.003 -0.029 -0.002 0.003 -0.002 -0.077 0.018 -0.081 -0.001 0.001 -0.001 0.001 -0.002 -0.005 0.001 -0.035 0.007 0.001 0.001 -0.001 -0.002 0.025 0.021 -0.001 0.007 -0.001 0.000 -0.005 0.003 0.001 -0.001 0.003 -0.000 -0.000 0.000 0.000 0.000 0.000 -0.493 0.206 0.472 0.039 -0.067 -0.181 -0.000 0.000 -0.001 -0.010 -0.008 0.032 -0.005 -0.001 -0.002 -0.001 -0.001 -0.000 -0.000 -0.000 -0.000 -0.005 -0.004 0.006 -0.006 -0.002 -0.006 0.003 0.007 -0.012 0.008 0.023 0.020 -0.003 0.001 0.006 0.008 -0.007 0.005 0.251 0.177 0.585 0.003 -0.002 0.000 0.001 -0.003 -0.001 0.004 0.016 0.033 -0.001 0.002 0.000 -0.069 0.017 -0.073 0.020 -0.011 0.011 -0.002 -0.001 0.010 -0.000 -0.001 -0.000 -0.000 0.000 0.002 0.004 -0.021 -0.018 0.000 0.000 0.000 0.000 0.002 -0.002 0.047 -0.037 0.176 0.002 0.000 -0.000 -0.006 0.010 0.004 0.007 -0.003 -0.007 -0.001 0.000 0.002 -0.062 0.028 -0.009 0.033 0.025 -0.090 -0.000 -0.000 -0.001 -0.004 -0.005 -0.000 0.001 -0.018 -0.024 0.001 0.001 -0.001 -0.377 -0.158 -0.414 0.145 0.408 -0.634 0.004 0.003 -0.001 0.003 -0.001 -0.006 -0.000 -0.000 -0.000 -0.003 -0.002 -0.006 -0.002 -0.000 -0.001 0.029 -0.125 -0.053 0.004 0.002 -0.003 0.005 -0.002 -0.001 -0.001 0.000 -0.001 -0.005 0.002 -0.004 0.001 -0.015 0.008 -0.009 0.209 -0.018 -0.002 -0.000 -0.000 -0.003 0.198 0.149 -0.015 -0.041 0.025 0.000 -0.002 0.001 -0.014 -0.005 -0.003 0.000 0.000 0.001 0.000 0.000 0.000 0.397 -0.150 -0.339 -0.083 0.009 -0.029 0.057 -0.030 0.011 0.090 0.080 -0.255 0.017 -0.000 0.000 0.003 0.002 0.000 0.002 -0.007 -0.000 0.105 0.076 -0.150 0.052 0.023 0.055 0.010 0.025 -0.035 -0.133 -0.132 0.021 0.004 -0.001 -0.007 -0.006 0.012 -0.002 0.260 0.157 0.522 -0.004 0.010 -0.001 0.001 -0.006 -0.001 -0.157 -0.076 -0.006 0.001 -0.001 0.001 0.096 -0.033 0.121 0.159 -0.077 0.115 -0.000 0.003 -0.002 0.015 -0.092 -0.003 -0.004 0.099 -0.036 0.000 -0.030 -0.023 -0.025 -0.027 0.063 0.019 -0.611 0.379 0.011 0.006 0.002 -0.007 -0.012 -0.003 -0.017 0.000 -0.009 -0.031 0.012 0.027 0.006 0.002 0.001 0.008 -0.005 -0.002 -0.014 -0.013 0.040 -0.140 0.043 -0.016 0.088 0.048 0.011 0.006 0.029 -0.003 0.254 0.182 -0.363 -0.055 -0.024 -0.058 -0.013 -0.034 0.047 0.014 0.010 -0.001 0.104 -0.048 -0.178 0.023 -0.005 0.014 -0.020 -0.013 -0.042 -0.139 0.053 -0.009 -0.013 0.049 0.021 0.017 0.008 0.000 0.030 -0.018 -0.243 -0.021 0.014 -0.028 -0.383 0.182 -0.277 0.003 -0.009 0.004 0.007 -0.064 0.002 -0.005 0.012 -0.002 0.001 0.044 0.033 -0.009 -0.003 0.018 0.002 -0.097 0.059 -0.073 -0.052 -0.012 -0.005 0.017 0.041 0.026 -0.002 0.027 -0.066 0.025 0.056 0.016 0.000 0.005 -0.126 0.074 0.002 0.021 0.021 -0.062 -0.038 0.015 -0.004 0.108 0.087 -0.005 -0.015 -0.168 0.011 0.074 0.053 -0.105 0.391 0.172 0.406 0.096 0.239 -0.341 0.011 0.019 -0.005 0.035 -0.011 -0.062 0.009 -0.003 0.006 -0.043 -0.026 -0.087 -0.040 0.015 -0.005 0.060 -0.213 -0.078 0.008 0.001 0.001 -0.002 0.027 0.061 -0.027 0.011 -0.031 -0.494 0.240 -0.356 0.002 0.016 -0.006 0.011 -0.062 -0.003 -0.000 -0.024 0.007 0.001 -0.140 -0.106 -0.028 -0.012 0.040 -0.005 0.106 -0.067 0.051 0.047 0.009 -0.004 0.027 0.055 0.036 -0.022 0.030 0.052 -0.019 -0.044 -0.017 0.001 -0.004 0.039 -0.022 -0.011 -0.060 -0.056 0.172 -0.017 0.018 -0.000 0.117 0.100 -0.013 -0.039 -0.022 0.032 0.167 0.118 -0.235 -0.263 -0.118 -0.274 -0.066 -0.159 0.230 0.021 -0.003 0.006 -0.004 0.007 0.007 0.026 -0.007 0.015 0.032 0.019 0.063 -0.027 0.011 -0.011 0.031 -0.068 -0.055 0.024 0.019 -0.002 -0.041 0.067 0.202 -0.126 0.034 -0.124 -0.206 0.100 -0.148 -0.004 -0.008 0.002 -0.024 0.185 0.002 -0.026 0.057 -0.011 -0.002 0.095 0.071 0.055 0.009 -0.073 0.012 -0.337 0.207 0.013 0.021 0.004 -0.009 0.007 0.033 0.010 -0.012 0.014 0.007 -0.005 -0.006 0.003 -0.003 0.000 0.083 -0.043 0.005 0.040 0.035 -0.113 -0.002 -0.016 -0.002 0.146 0.107 0.003 -0.016 -0.016 0.015 -0.299 -0.210 0.422 -0.095 -0.043 -0.099 -0.026 -0.061 0.090 -0.030 -0.013 -0.002 0.096 -0.036 -0.170 -0.055 0.021 -0.030 0.006 0.004 0.014 0.017 0.005 0.025 0.019 -0.033 -0.027 -0.031 -0.019 0.001 0.017 0.012 -0.110 0.339 -0.090 0.342 -0.055 0.028 -0.040 -0.019 -0.041 0.012 0.015 -0.152 0.006 0.007 -0.017 0.004 -0.005 0.428 0.321 -0.019 0.008 0.025 -0.004 0.095 -0.059 0.002 0.023 0.002 0.002 0.004 0.004 0.005 -0.004 0.003 -0.183 0.070 0.156 0.054 0.006 0.011 0.243 -0.127 0.027 0.182 0.163 -0.511 -0.011 0.009 0.000 -0.005 -0.002 -0.004 -0.002 0.026 0.005 0.101 0.070 -0.142 -0.090 -0.040 -0.094 -0.027 -0.068 0.101 -0.063 0.008 -0.017 -0.023 0.010 0.040 0.022 -0.010 0.011 -0.116 -0.069 -0.232 -0.014 -0.001 -0.010 0.002 0.019 -0.003 -0.056 -0.068 0.010 -0.018 0.017 0.069 -0.139 0.039 -0.146 -0.006 0.004 -0.006 -0.000 0.000 -0.000 0.000 -0.003 0.000 -0.003 -0.002 0.002 0.000 -0.000 -0.000 -0.001 0.001 0.000 -0.000 0.012 -0.007 0.000 0.000 -0.000 -0.030 -0.011 0.040 0.002 0.002 0.002 0.000 -0.000 -0.000 -0.000 0.000 -0.000 0.001 -0.001 0.000 -0.000 -0.000 0.000 0.008 -0.002 0.002 -0.003 -0.004 -0.006 -0.000 -0.001 0.001 0.002 0.001 -0.003 -0.001 -0.000 -0.001 -0.000 -0.001 0.001 0.000 -0.000 0.000 0.003 0.005 0.007 0.001 -0.000 0.001 0.000 0.000 0.000 0.004 -0.002 -0.001 0.002 -0.001 -0.003 0.000 -0.000 0.000 0.271 -0.161 -0.947 -0.009 0.002 -0.008 -0.001 0.000 -0.000 -0.000 0.000 -0.000 -0.000 0.000 -0.000 0.000 -0.000 -0.001 0.000 -0.000 -0.000 0.000 -0.000 -0.000 0.000 -0.001 0.001 -0.000 0.000 0.000 0.046 0.045 0.005 0.000 0.000 0.000 -0.000 0.000 0.000 -0.000 -0.000 0.000 0.000 -0.000 0.000 0.000 -0.000 0.000 -0.001 0.000 -0.000 0.003 0.002 -0.000 -0.000 -0.001 -0.000 -0.000 -0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 0.000 0.000 0.000 0.000 -0.004 -0.001 0.004 -0.000 0.000 -0.000 0.000 0.000 -0.000 -0.000 0.000 0.000 0.000 -0.001 -0.000 0.000 0.000 0.000 -0.698 -0.705 -0.109 0.001 0.000 0.001 -0.000 0.000 -0.000 0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 0.000 0.000 0.000 -0.000 0.000 -0.000 0.000 0.000 -0.000 0.000 0.000 0.000 0.000 0.000 -0.000 0.000 -0.000 -0.000 0.000 0.000 -0.000 -0.000 0.000 -0.000 -0.000 -0.000 0.000 -0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 -0.000 -0.000 0.000 -0.000 -0.000 0.000 0.000 0.000 0.000 -0.019 0.049 0.033 0.000 -0.000 0.000 -0.000 0.000 0.000 0.000 -0.000 -0.000 -0.000 -0.000 0.000 -0.000 -0.000 -0.000 0.296 -0.789 -0.535 -28.206991 5.913412 17.352632 33.678396 34.227237 42.435055 49.416100 52.498775 61.885594 64.431629 69.383343 85.925032 89.489560 104.806160 117.235455 135.235402 140.915302 144.280908 165.320779 169.233929 177.391268 183.579673 186.524675 199.577610 203.441050 208.301258 219.636316 225.452356 230.038738 234.791024 243.878413 249.270279 257.478687 266.900823 279.826657 284.836568 297.058379 313.059934 316.139418 319.174073 323.466411 325.177855 333.072038 336.404764 338.230858 342.905700 371.456688 390.787333 409.720940 418.324870 456.590074 463.047136 503.382609 526.735569 548.011878 572.911189 576.694812 581.775622 615.563472 640.153562 651.403305 668.447650 682.592708 713.437380 741.246126 781.206293 794.324981 832.714330 841.482199 845.970860 856.766113 861.874259 889.469210 896.595316 902.192362 911.107222 914.481751 915.643538 1019.725872 3191.803387 3612.422824 1011.723868 0.000000 0.000000 56.362705 146.942911 360.024093 39.111863 283.058468 362.573838 213.737194 508.859067 1311.400967 434.492582 238.993675 161.480011 418.199811 790.401864 251.657521 370.700686 105.515665 491.758520 268.551517 1132.515694 398.916648 249.740668 66.250860 1634.530638 3689.556683 2532.418606 7888.493043 455.141380 2217.574691 716.793826 271.858734 1049.347134 127.542117 642.082508 71.710885 424.527174 1329.745176 475.545824 194.436146 1387.991382 376.335177 1028.808782 594.926891 1578.478920 250.474090 760.190768 1541.081690 2236.866373 1697.519907 157.764453 2180.505542 4970.878978 5859.006629 1856.017706 2506.982051 11713.748992 465.540473 11672.697634 634.018631 11106.428738 13042.843785 1250.907387 637.859589 1446.477367 1707.658038 3513.725427 1549.546614 2441.158593 2695.134814 2209.713045 1045.960198 675.010662 863.142197 432.077690 257.875737 682.743077 1310.786139 156.982081 -7.153142 0.000000 0.000000 0.475797 1.260662 3.829432 0.484457 3.724804 5.624243 3.451893 8.849746 28.244460 9.746144 6.278433 4.745214 14.175954 27.917992 9.101162 15.361333 4.475921 21.865640 12.357490 52.949101 19.955934 12.735205 3.459087 89.986070 208.500469 146.020739 464.251812 27.822603 138.556475 46.260850 18.187427 73.601444 9.105996 47.809116 5.627178 33.640482 106.383457 38.556680 15.848057 115.878540 31.733284 87.221984 51.134778 146.968763 24.534734 78.070834 161.591092 256.002718 197.023554 19.906066 287.890883 682.812136 841.374535 268.291077 365.582008 1807.368982 74.699841 1905.896285 106.230076 1900.264912 2332.417134 232.415808 124.901856 287.996980 356.430627 741.123910 328.577726 524.247474 582.240584 492.657240 235.065933 152.646851 197.119645 99.040986 59.185455 174.509395 1048.687380 142.143410 -28.207 -5.219 -0.072 0.041 -0.010 6.812 -0.00004225 40.990680 1.000000 298.150000 24764.0544 27964.3438 49435.4725 1 NOSYM 298.15 46.859 38.768 122.869 208.495 0.889 0.889 73.013 74.791 2.981 2.981 107.217 113.178 1087.4274000000003 AuxInfo=1/1/N:4;8;12;6;9;23;1;3;5;7;11;13;14;15;16;17;18;19;20;21;22;24;25;26;27;2;10/rA:29nO1WOMoO1MoO1MoOWO1MoOO1OOOO1O1O1OO1OO1OOOHH/rB:;;;s2;s3;s4;;;s1s9;;s3s11;s2s8;s2;s4s6;s4s10;s8s10;s6;s8;s8;s2s12;s4;s6;s12;s4s6;s8s10;s2s12;s9;s23;/rC:4.1784,-2.126,1.2952;-.0815,3.3397,-.0825;-3.0027,-.032,.5142;-.1787,-3.5737,.0274;-.098,4.7207,1.0152;-2.7675,-1.8282,.434;-.1331,-5.0462,.9612;3.2067,1.6295,.1188;2.795,-2.1821,-1.4898;2.8604,-1.4776,.3422;-4.1094,2.4679,.94;-2.8635,1.9777,-.1968;1.5561,2.5415,.5596;.4842,3.8105,-1.6826;-1.9819,-3.4855,-.5676;1.4759,-2.6782,.7559;3.8557,-.0379,-.6335;-3.6978,-2.4894,1.7447;4.353,2.1257,1.3382;3.5705,2.5786,-1.3083;-2.0488,3.633,-.6224;.6337,-3.8458,-1.5247;-3.9131,-1.9728,-1.1616;-3.5827,1.517,-1.7291;-.9676,-1.9228,.9854;2.134,.0077,1.1479;-.9724,1.6264,.3101;2.0813,-2.8762,-1.5804;-3.6069,-2.7522,-1.6716;/R:/0/N:6,4,12,8,23,18,7,22,11,24,19,20,9,1,5,14,15,25,3,16,21,27,17,26,13,10,2/E:(7,8)(9,10)(11,12)(15,16)(17,18)(21,22)(23,24)/CRV:6.1,7.1,8.1,9.1,10.1,11.1,12.1,14.1,15.1,16.1 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -6.607 -6.576 -6.559 -6.546 -6.485 -6.420 -6.365 -6.351 -6.300 -6.194 -3.228 -3.016 -2.757 -2.675 -2.588 -2.473 -2.363 -2.206 -2.100 -2.003 A A A A A A A A A A A A A A A A A A A A 0.00000000043034 0.00022799719265 0.00014183658483 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 74 74 42 42 42 42 1 1 4.178355 -2.126034 1.295187 -3.002682 -0.032031 0.514236 -0.097952 4.720663 1.015229 -0.133132 -5.046231 0.961215 2.794991 -2.182089 -1.489804 -4.109418 2.467852 0.940016 1.556089 2.541470 0.559566 0.484227 3.810499 -1.682605 -1.981946 -3.485538 -0.567608 1.475908 -2.678212 0.755899 3.855695 -0.037874 -0.633536 -3.697848 -2.489376 1.744701 4.353036 2.125725 1.338186 3.570502 2.578578 -1.308285 -2.048814 3.632971 -0.622399 0.633715 -3.845751 -1.524657 -3.913069 -1.972838 -1.161603 -3.582673 1.517013 -1.729051 -0.967629 -1.922827 0.985409 2.133972 0.007673 1.147882 -0.972428 1.626353 0.310149 -0.081516 3.339691 -0.082469 2.860401 -1.477554 0.342221 -0.178744 -3.573691 0.027439 -2.767471 -1.828182 0.433972 3.206691 1.629473 0.118790 -2.863489 1.977718 -0.196784 2.081289 -2.876210 -1.580387 -3.606858 -2.752242 -1.671608 1 3 -3 4.178355 -2.126034 1.295187 Rho 0.3192744E+03 3,-3 2 3 -3 -3.002682 -0.032031 0.514236 Rho 0.3190868E+03 3,-3 3 3 -3 -0.097952 4.720663 1.015229 Rho 0.3192392E+03 3,-3 4 3 -3 -0.133132 -5.046231 0.961215 Rho 0.3193939E+03 3,-3 5 3 -3 2.794991 -2.182089 -1.489804 Rho 0.3187605E+03 3,-3 6 3 -3 -4.109418 2.467852 0.940016 Rho 0.3193622E+03 3,-3 7 3 -3 1.556089 2.541470 0.559566 Rho 0.3188778E+03 3,-3 8 3 -3 0.484227 3.810499 -1.682605 Rho 0.3192579E+03 3,-3 9 3 -3 -1.981946 -3.485538 -0.567608 Rho 0.3191127E+03 3,-3 10 3 -3 1.475908 -2.678212 0.755899 Rho 0.3189528E+03 3,-3 11 3 -3 3.855695 -0.037874 -0.633536 Rho 0.3190518E+03 3,-3 12 3 -3 -3.697848 -2.489376 1.744701 Rho 0.3194077E+03 3,-3 13 3 -3 4.353036 2.125725 1.338186 Rho 0.3193809E+03 3,-3 14 3 -3 3.570502 2.578578 -1.308285 Rho 0.3193901E+03 3,-3 15 3 -3 -2.048814 3.632971 -0.622399 Rho 0.3190632E+03 3,-3 16 3 -3 0.633715 -3.845751 -1.524657 Rho 0.3193251E+03 3,-3 17 3 -3 -3.913069 -1.972838 -1.161603 Rho 0.3188349E+03 3,-3 18 3 -3 -3.582673 1.517013 -1.729051 Rho 0.3193790E+03 3,-3 19 3 -3 -0.967629 -1.922827 0.985409 Rho 0.3191745E+03 3,-3 20 3 -3 2.133972 0.007673 1.147882 Rho 0.3191385E+03 3,-3 21 3 -3 -0.972428 1.626353 0.310149 Rho 0.3190895E+03 3,-3 22 3 -3 -0.081516 3.339691 -0.082469 Rho 0.4361415E+07 3,-3 23 3 -3 2.860401 -1.477554 0.342221 Rho 0.4361416E+07 3,-3 24 3 -3 -0.178744 -3.573691 0.027439 Rho 0.1240650E+06 3,-3 25 3 -3 -2.767471 -1.828182 0.433972 Rho 0.1240650E+06 3,-3 26 3 -3 3.206691 1.629473 0.118790 Rho 0.1240649E+06 3,-3 27 3 -3 -2.863489 1.977718 -0.196784 Rho 0.1240648E+06 3,-3 28 3 -3 2.081289 -2.876210 -1.580387 Rho 0.4441229E+00 3,-3 29 3 -3 -3.606858 -2.752242 -1.671608 Rho 0.4677577E+00 3,-3 30 3 -1 -1.118468 3.482318 -0.361759 Rho 0.1080171E+00 |GRAD(Rho)| 0.5040094E-15 GRAD(Rho)x 0.4762019E-15 GRAD(Rho)y -0.8521829E-16 GRAD(Rho)z 0.1414037E-15 Laplacian 0.4129413E+00 (-1/4)Del**2(Rho)) -0.1032353E+00 Diamond 0.5615968E+00 Metallicity 0.4088330E+01 Ellipticity 0.5330809E-01 Gb(Abramov) 0.1391669E+00 Vb(Abramov) -0.1750985E+00 Hb(Abramov) -0.3593157E-01 Ex_ueg -0.3799344E-01 Ec_ueg -0.5813209E-02 Delta_ex -0.4094397E-01 Delta_ec 0.1126258E-01 Delta_et -0.1419318E+00 Pxc 0.6535708E+01 Qxc -0.3635398E+01 3,-1 31 3 -1 -3.246555 1.729343 -1.016356 Rho 0.2186297E+00 |GRAD(Rho)| 0.2836829E-14 GRAD(Rho)x -0.8944126E-15 GRAD(Rho)y -0.1849771E-14 GRAD(Rho)z 0.1956009E-14 Laplacian 0.7842483E+00 (-1/4)Del**2(Rho)) -0.1960621E+00 Diamond 0.2492972E+01 Metallicity 0.6971747E+01 Ellipticity 0.2970675E-01 Gb(Abramov) 0.3585239E+00 Vb(Abramov) -0.5209857E+00 Hb(Abramov) -0.1624618E+00 Ex_ueg -0.9727413E-01 Ec_ueg -0.1297437E-01 Delta_ex -0.9256775E-01 Delta_ec 0.1794753E-01 Delta_et -0.2481130E+00 Pxc 0.7497406E+01 Qxc -0.5157687E+01 3,-1 32 3 -1 -3.528729 2.238342 0.412860 Rho 0.2174764E+00 |GRAD(Rho)| 0.9269569E-15 GRAD(Rho)x -0.6969794E-15 GRAD(Rho)y -0.8890458E-17 GRAD(Rho)z 0.6110563E-15 Laplacian 0.7786842E+00 (-1/4)Del**2(Rho)) -0.1946711E+00 Diamond 0.2460685E+01 Metallicity 0.6959936E+01 Ellipticity 0.2716102E-01 Gb(Abramov) 0.3555971E+00 Vb(Abramov) -0.5165231E+00 Hb(Abramov) -0.1609260E+00 Ex_ueg -0.9659052E-01 Ec_ueg -0.1289603E-01 Delta_ex -0.9179235E-01 Delta_ec 0.1785876E-01 Delta_et -0.2468508E+00 Pxc 0.7489940E+01 Qxc -0.5139907E+01 3,-1 33 3 +1 -1.477613 -2.704625 0.209864 Rho 0.4477581E-01 |GRAD(Rho)| 0.5261654E-16 GRAD(Rho)x -0.5901939E-17 GRAD(Rho)y -0.3884509E-16 GRAD(Rho)z -0.3499609E-16 Laplacian 0.1723396E+00 (-1/4)Del**2(Rho)) -0.4308490E-01 Diamond 0.4057483E-01 Metallicity 0.2257531E+01 Ellipticity -0.3594937E+01 Gb(Abramov) 0.4493418E-01 Vb(Abramov) -0.4678347E-01 Hb(Abramov) -0.1849285E-02 Ex_ueg -0.1174292E-01 Ec_ueg -0.2128202E-02 Delta_ex -0.1206996E-01 Delta_ec 0.2053023E-02 Delta_et -0.2042548E-01 Pxc 0.5517767E+01 Qxc -0.5879116E+01 3,+1 34 3 +1 1.573121 -2.912761 -0.706683 Rho 0.1395915E-01 |GRAD(Rho)| 0.3269286E-15 GRAD(Rho)x 0.1400149E-15 GRAD(Rho)y 0.4013530E-16 GRAD(Rho)z -0.2926898E-15 Laplacian 0.6289076E-01 (-1/4)Del**2(Rho)) -0.1572269E-01 Diamond 0.3039278E-02 Metallicity 0.8867302E+00 Ellipticity -0.1403267E+01 Gb(Abramov) 0.1280542E-01 Vb(Abramov) -0.9888158E-02 Hb(Abramov) 0.2917266E-02 Ex_ueg -0.2482355E-02 Ec_ueg -0.5507492E-03 Delta_ex -0.3203200E-02 Delta_ec 0.7900486E-03 Delta_et -0.6163952E-02 Pxc 0.4507232E+01 Qxc -0.4054434E+01 3,+1 35 3 -1 -1.133526 -3.513298 -0.279041 Rho 0.1539189E+00 |GRAD(Rho)| 0.7399728E-16 GRAD(Rho)x -0.2222614E-16 GRAD(Rho)y -0.5656825E-16 GRAD(Rho)z -0.4220935E-16 Laplacian 0.5494705E+00 (-1/4)Del**2(Rho)) -0.1373676E+00 Diamond 0.1168220E+01 Metallicity 0.5543984E+01 Ellipticity 0.9069550E-01 Gb(Abramov) 0.2185057E+00 Vb(Abramov) -0.2996438E+00 Hb(Abramov) -0.8113811E-01 Ex_ueg -0.6092201E-01 Ec_ueg -0.8694849E-02 Delta_ex -0.5957335E-01 Delta_ec 0.1419026E-01 Delta_et -0.1903784E+00 Pxc 0.7006679E+01 Qxc -0.4198186E+01 3,-1 36 3 -1 -0.590903 -2.707702 0.524381 Rho 0.1027077E+00 |GRAD(Rho)| 0.2272123E-16 GRAD(Rho)x 0.1719985E-16 GRAD(Rho)y -0.3760826E-17 GRAD(Rho)z 0.1436229E-16 Laplacian 0.3741648E+00 (-1/4)Del**2(Rho)) -0.9354119E-01 Diamond 0.4767005E+00 Metallicity 0.4148477E+01 Ellipticity 0.7724457E-01 Gb(Abramov) 0.1270364E+00 Vb(Abramov) -0.1605316E+00 Hb(Abramov) -0.3349519E-01 Ex_ueg -0.3552405E-01 Ec_ueg -0.5489366E-02 Delta_ex -0.3662701E-01 Delta_ec 0.1025721E-01 Delta_et -0.1279406E+00 Pxc 0.6471431E+01 Qxc -0.3570855E+01 3,-1 37 3 -1 0.222540 3.593768 -0.948777 Rho 0.2297546E+00 |GRAD(Rho)| 0.1281054E-14 GRAD(Rho)x -0.3335819E-15 GRAD(Rho)y -0.3116268E-15 GRAD(Rho)z 0.1196959E-14 Laplacian 0.8387258E+00 (-1/4)Del**2(Rho)) -0.2096814E+00 Diamond 0.2819057E+01 Metallicity 0.7081092E+01 Ellipticity 0.2477949E-01 Gb(Abramov) 0.3872499E+00 Vb(Abramov) -0.5648183E+00 Hb(Abramov) -0.1775684E+00 Ex_ueg -0.1039291E+00 Ec_ueg -0.1373375E-01 Delta_ex -0.1002149E+00 Delta_ec 0.1881165E-01 Delta_et -0.2603087E+00 Pxc 0.7567424E+01 Qxc -0.5327278E+01 3,-1 38 3 -1 2.808485 -1.860689 -0.623560 Rho 0.1399885E+00 |GRAD(Rho)| 0.3259944E-12 GRAD(Rho)x 0.3672711E-13 GRAD(Rho)y 0.1220388E-12 GRAD(Rho)z 0.3000500E-12 Laplacian 0.5021780E+00 (-1/4)Del**2(Rho)) -0.1255445E+00 Diamond 0.9583613E+00 Metallicity 0.5178965E+01 Ellipticity 0.1432137E+00 Gb(Abramov) 0.1920614E+00 Vb(Abramov) -0.2585783E+00 Hb(Abramov) -0.6651692E-01 Ex_ueg -0.5368361E-01 Ec_ueg -0.7805749E-02 Delta_ex -0.5326266E-01 Delta_ec 0.1338342E-01 Delta_et -0.1772678E+00 Pxc 0.6877445E+01 Qxc -0.3979749E+01 3,-1 39 3 -1 3.574506 -1.828224 0.858167 Rho 0.2362116E+00 |GRAD(Rho)| 0.4613747E-15 GRAD(Rho)x -0.1177444E-15 GRAD(Rho)y 0.3559978E-15 GRAD(Rho)z -0.2688279E-15 Laplacian 0.8394733E+00 (-1/4)Del**2(Rho)) -0.2098683E+00 Diamond 0.2925442E+01 Metallicity 0.7409264E+01 Ellipticity 0.1166581E-01 Gb(Abramov) 0.3990739E+00 Vb(Abramov) -0.5882794E+00 Hb(Abramov) -0.1892055E+00 Ex_ueg -0.1078417E+00 Ec_ueg -0.1417763E-01 Delta_ex -0.1010747E+00 Delta_ec 0.1875607E-01 Delta_et -0.2601916E+00 Pxc 0.7606471E+01 Qxc -0.5388905E+01 3,-1 40 3 -1 0.686731 -3.091779 0.400839 Rho 0.1096514E+00 |GRAD(Rho)| 0.2434894E-15 GRAD(Rho)x 0.2148008E-15 GRAD(Rho)y 0.1042020E-15 GRAD(Rho)z 0.4785059E-16 Laplacian 0.4471452E+00 (-1/4)Del**2(Rho)) -0.1117863E+00 Diamond 0.6249342E+00 Metallicity 0.3871282E+01 Ellipticity 0.2917643E-01 Gb(Abramov) 0.1466502E+00 Vb(Abramov) -0.1815142E+00 Hb(Abramov) -0.3486394E-01 Ex_ueg -0.3876179E-01 Ec_ueg -0.5913318E-02 Delta_ex -0.4457914E-01 Delta_ec 0.1230851E-01 Delta_et -0.1557697E+00 Pxc 0.6554999E+01 Qxc -0.3621815E+01 3,-1 41 3 -1 -0.562271 2.435331 0.122776 Rho 0.1379746E+00 |GRAD(Rho)| 0.3998633E-15 GRAD(Rho)x 0.2318228E-15 GRAD(Rho)y 0.3100818E-15 GRAD(Rho)z -0.9999055E-16 Laplacian 0.4991263E+00 (-1/4)Del**2(Rho)) -0.1247816E+00 Diamond 0.9119115E+00 Metallicity 0.5086290E+01 Ellipticity 0.8029760E-01 Gb(Abramov) 0.1889669E+00 Vb(Abramov) -0.2531523E+00 Hb(Abramov) -0.6418535E-01 Ex_ueg -0.5265631E-01 Ec_ueg -0.7678215E-02 Delta_ex -0.5248461E-01 Delta_ec 0.1286748E-01 Delta_et -0.1690922E+00 Pxc 0.6857885E+01 Qxc -0.4078856E+01 3,-1 42 3 -1 -0.092029 4.086086 0.511223 Rho 0.2280750E+00 |GRAD(Rho)| 0.6389581E-13 GRAD(Rho)x 0.2535525E-13 GRAD(Rho)y -0.5354978E-13 GRAD(Rho)z -0.2392086E-13 Laplacian 0.8308012E+00 (-1/4)Del**2(Rho)) -0.2077003E+00 Diamond 0.2765800E+01 Metallicity 0.7061748E+01 Ellipticity 0.2295187E-01 Gb(Abramov) 0.3829214E+00 Vb(Abramov) -0.5581425E+00 Hb(Abramov) -0.1752211E+00 Ex_ueg -0.1029174E+00 Ec_ueg -0.1361867E-01 Delta_ex -0.9906724E-01 Delta_ec 0.1865241E-01 Delta_et -0.2579278E+00 Pxc 0.7557079E+01 Qxc -0.5311231E+01 3,-1 43 3 -1 2.474463 -0.676560 0.769937 Rho 0.1908388E+00 |GRAD(Rho)| 0.7493527E-15 GRAD(Rho)x -0.2895633E-15 GRAD(Rho)y 0.5340238E-15 GRAD(Rho)z 0.4387495E-15 Laplacian 0.6868236E+00 (-1/4)Del**2(Rho)) -0.1717059E+00 Diamond 0.1885634E+01 Metallicity 0.6346668E+01 Ellipticity 0.6117774E-01 Gb(Abramov) 0.2960973E+00 Vb(Abramov) -0.4204887E+00 Hb(Abramov) -0.1243914E+00 Ex_ueg -0.8114728E-01 Ec_ueg -0.1110730E-01 Delta_ex -0.7852440E-01 Delta_ec 0.1672492E-01 Delta_et -0.2301237E+00 Pxc 0.7305762E+01 Qxc -0.4695055E+01 3,-1 44 3 -1 2.645644 0.780246 0.645408 Rho 0.7334689E-01 |GRAD(Rho)| 0.8423521E-13 GRAD(Rho)x 0.4519275E-13 GRAD(Rho)y 0.6473086E-13 GRAD(Rho)z -0.2937861E-13 Laplacian 0.2806150E+00 (-1/4)Del**2(Rho)) -0.7015376E-01 Diamond 0.2303028E+00 Metallicity 0.3156010E+01 Ellipticity 0.3065816E-01 Gb(Abramov) 0.8367017E-01 Vb(Abramov) -0.9718659E-01 Hb(Abramov) -0.1351641E-01 Ex_ueg -0.2267570E-01 Ec_ueg -0.3741170E-02 Delta_ex -0.2523387E-01 Delta_ec 0.7912013E-02 Delta_et -0.9161352E-01 Pxc 0.6061125E+01 Qxc -0.3189311E+01 3,-1 45 3 -1 2.329237 2.104698 0.337593 Rho 0.1328437E+00 |GRAD(Rho)| 0.1241703E-12 GRAD(Rho)x 0.1120045E-12 GRAD(Rho)y -0.4994239E-13 GRAD(Rho)z -0.1946806E-13 Laplacian 0.5439806E+00 (-1/4)Del**2(Rho)) -0.1359951E+00 Diamond 0.9490134E+00 Metallicity 0.4381248E+01 Ellipticity 0.1862699E-01 Gb(Abramov) 0.1899682E+00 Vb(Abramov) -0.2439412E+00 Hb(Abramov) -0.5397302E-01 Ex_ueg -0.5006176E-01 Ec_ueg -0.7354481E-02 Delta_ex -0.5667035E-01 Delta_ec 0.1414018E-01 Delta_et -0.1847037E+00 Pxc 0.6806974E+01 Qxc -0.4007755E+01 3,-1 46 3 +1 -1.454110 2.666394 -0.150785 Rho 0.4571808E-01 |GRAD(Rho)| 0.7122633E-15 GRAD(Rho)x 0.1229466E-15 GRAD(Rho)y -0.6768107E-15 GRAD(Rho)z 0.1847440E-15 Laplacian 0.1645793E+00 (-1/4)Del**2(Rho)) -0.4114483E-01 Diamond 0.3544287E-01 Metallicity 0.2447473E+01 Ellipticity -0.2834415E+01 Gb(Abramov) 0.4421336E-01 Vb(Abramov) -0.4728189E-01 Hb(Abramov) -0.3068531E-02 Ex_ueg -0.1207357E-01 Ec_ueg -0.2179589E-02 Delta_ex -0.1137979E-01 Delta_ec 0.1575192E-02 Delta_et -0.1551913E-01 Pxc 0.5539379E+01 Qxc -0.7224382E+01 3,+1 47 3 -1 -2.421692 2.848102 -0.417569 Rho 0.1553772E+00 |GRAD(Rho)| 0.3974577E-15 GRAD(Rho)x 0.2521448E-15 GRAD(Rho)y 0.2888044E-15 GRAD(Rho)z -0.1048220E-15 Laplacian 0.5698428E+00 (-1/4)Del**2(Rho)) -0.1424607E+00 Diamond 0.1214531E+01 Metallicity 0.5430465E+01 Ellipticity 0.9761339E-01 Gb(Abramov) 0.2239118E+00 Vb(Abramov) -0.3053628E+00 Hb(Abramov) -0.8145106E-01 Ex_ueg -0.6169285E-01 Ec_ueg -0.8788617E-02 Delta_ex -0.6182270E-01 Delta_ec 0.1449873E-01 Delta_et -0.1943394E+00 Pxc 0.7019631E+01 Qxc -0.4264007E+01 3,-1 48 3 -1 -1.868219 1.795238 0.069100 Rho 0.1249986E+00 |GRAD(Rho)| 0.2251684E-12 GRAD(Rho)x -0.2141575E-12 GRAD(Rho)y 0.3944788E-13 GRAD(Rho)z -0.5728198E-13 Laplacian 0.4401651E+00 (-1/4)Del**2(Rho)) -0.1100413E+00 Diamond 0.7141003E+00 Metallicity 0.4892223E+01 Ellipticity 0.8276535E-01 Gb(Abramov) 0.1630853E+00 Vb(Abramov) -0.2161293E+00 Hb(Abramov) -0.5304398E-01 Ex_ueg -0.4615924E-01 Ec_ueg -0.6862846E-02 Delta_ex -0.4519178E-01 Delta_ec 0.1161743E-01 Delta_et -0.1502716E+00 Pxc 0.6725962E+01 Qxc -0.3889998E+01 3,-1 49 3 +1 2.992680 0.240482 0.265386 Rho 0.4178381E-01 |GRAD(Rho)| 0.8530479E-16 GRAD(Rho)x -0.5313775E-16 GRAD(Rho)y 0.1751069E-16 GRAD(Rho)z 0.6439458E-16 Laplacian 0.1561199E+00 (-1/4)Del**2(Rho)) -0.3902997E-01 Diamond 0.2585636E-01 Metallicity 0.2220760E+01 Ellipticity -0.1886020E+01 Gb(Abramov) 0.4046601E-01 Vb(Abramov) -0.4190205E-01 Hb(Abramov) -0.1436042E-02 Ex_ueg -0.1070851E-01 Ec_ueg -0.1966018E-02 Delta_ex -0.1030711E-01 Delta_ec 0.1123996E-02 Delta_et -0.1079060E-01 Pxc 0.5446801E+01 Qxc -0.9170059E+01 3,+1 50 3 -1 3.537581 0.741544 -0.269612 Rho 0.1387249E+00 |GRAD(Rho)| 0.4096427E-15 GRAD(Rho)x 0.1662285E-15 GRAD(Rho)y -0.3737245E-15 GRAD(Rho)z 0.2247687E-16 Laplacian 0.4973837E+00 (-1/4)Del**2(Rho)) -0.1243459E+00 Diamond 0.9241362E+00 Metallicity 0.5150456E+01 Ellipticity 0.8718688E-01 Gb(Abramov) 0.1896370E+00 Vb(Abramov) -0.2549280E+00 Hb(Abramov) -0.6529106E-01 Ex_ueg -0.5303847E-01 Ec_ueg -0.7725699E-02 Delta_ex -0.5247513E-01 Delta_ec 0.1299254E-01 Delta_et -0.1712619E+00 Pxc 0.6865199E+01 Qxc -0.4038867E+01 3,-1 51 3 -1 3.398686 2.133900 -0.646179 Rho 0.2186205E+00 |GRAD(Rho)| 0.2411489E-15 GRAD(Rho)x 0.1235990E-16 GRAD(Rho)y -0.1272311E-15 GRAD(Rho)z 0.2044805E-15 Laplacian 0.8287896E+00 (-1/4)Del**2(Rho)) -0.2071974E+00 Diamond 0.2611889E+01 Metallicity 0.6596601E+01 Ellipticity 0.2660248E-01 Gb(Abramov) 0.3659313E+00 Vb(Abramov) -0.5246653E+00 Hb(Abramov) -0.1587339E+00 Ex_ueg -0.9726862E-01 Ec_ueg -0.1297374E-01 Delta_ex -0.9768821E-01 Delta_ec 0.1872454E-01 Delta_et -0.2579119E+00 Pxc 0.7497346E+01 Qxc -0.5217122E+01 3,-1 52 3 -1 -0.154546 -4.361904 0.527369 Rho 0.2243298E+00 |GRAD(Rho)| 0.1255939E-14 GRAD(Rho)x -0.4174178E-17 GRAD(Rho)y 0.1175329E-14 GRAD(Rho)z -0.4426797E-15 Laplacian 0.7867063E+00 (-1/4)Del**2(Rho)) -0.1966766E+00 Diamond 0.2593354E+01 Metallicity 0.7254579E+01 Ellipticity 0.1754228E-01 Gb(Abramov) 0.3689187E+00 Vb(Abramov) -0.5411608E+00 Hb(Abramov) -0.1722421E+00 Ex_ueg -0.1006702E+00 Ec_ueg -0.1336261E-01 Delta_ex -0.9355872E-01 Delta_ec 0.1801734E-01 Delta_et -0.2500332E+00 Pxc 0.7533726E+01 Qxc -0.5192705E+01 3,-1 53 3 -1 1.580974 -3.188709 -1.542446 Rho 0.4039299E-01 |GRAD(Rho)| 0.7372183E-16 GRAD(Rho)x 0.5940179E-16 GRAD(Rho)y -0.4295991E-16 GRAD(Rho)z 0.7796269E-17 Laplacian 0.1190065E+00 (-1/4)Del**2(Rho)) -0.2975163E-01 Diamond 0.6804378E-01 Metallicity 0.2753504E+01 Ellipticity 0.1507216E-01 Gb(Abramov) 0.3348796E-01 Vb(Abramov) -0.3722429E-01 Hb(Abramov) -0.3736329E-02 Ex_ueg -0.1023591E-01 Ec_ueg -0.1891157E-02 Delta_ex -0.1059939E-01 Delta_ec 0.5894026E-02 Delta_et -0.5901537E-01 Pxc 0.5412512E+01 Qxc -0.1798328E+01 3,-1 54 3 -1 0.258171 -3.712898 -0.800488 Rho 0.2084743E+00 |GRAD(Rho)| 0.3316020E-15 GRAD(Rho)x 0.7388838E-16 GRAD(Rho)y -0.1291014E-15 GRAD(Rho)z -0.2963667E-15 Laplacian 0.7627121E+00 (-1/4)Del**2(Rho)) -0.1906780E+00 Diamond 0.2290244E+01 Metallicity 0.6622266E+01 Ellipticity 0.2082362E-01 Gb(Abramov) 0.3375721E+00 Vb(Abramov) -0.4844662E+00 Hb(Abramov) -0.1468941E+00 Ex_ueg -0.9129668E-01 Ec_ueg -0.1228712E-01 Delta_ex -0.8893408E-01 Delta_ec 0.1769483E-01 Delta_et -0.2438634E+00 Pxc 0.7430276E+01 Qxc -0.5025994E+01 3,-1 55 3 -1 3.380049 -0.715727 -0.176744 Rho 0.1259806E+00 |GRAD(Rho)| 0.6111841E-15 GRAD(Rho)x -0.1341158E-15 GRAD(Rho)y -0.5863230E-15 GRAD(Rho)z 0.1085557E-15 Laplacian 0.4721129E+00 (-1/4)Del**2(Rho)) -0.1180282E+00 Diamond 0.7860810E+00 Metallicity 0.4621045E+01 Ellipticity 0.5896782E-01 Gb(Abramov) 0.1695878E+00 Vb(Abramov) -0.2211473E+00 Hb(Abramov) -0.5155955E-01 Ex_ueg -0.4664339E-01 Ec_ueg -0.6924161E-02 Delta_ex -0.4872537E-01 Delta_ec 0.1272736E-01 Delta_et -0.1653605E+00 Pxc 0.6736323E+01 Qxc -0.3828396E+01 3,-1 56 3 -1 -2.885324 -0.871252 0.460298 Rho 0.1804841E+00 |GRAD(Rho)| 0.8372660E-15 GRAD(Rho)x 0.2152141E-16 GRAD(Rho)y -0.8360283E-15 GRAD(Rho)z -0.4009854E-16 Laplacian 0.7612438E+00 (-1/4)Del**2(Rho)) -0.1903110E+00 Diamond 0.1877967E+01 Metallicity 0.5217802E+01 Ellipticity 0.4318745E-01 Gb(Abramov) 0.2923748E+00 Vb(Abramov) -0.3944386E+00 Hb(Abramov) -0.1020638E+00 Ex_ueg -0.7533040E-01 Ec_ueg -0.1042273E-01 Delta_ex -0.8522371E-01 Delta_ec 0.1774787E-01 Delta_et -0.2396466E+00 Pxc 0.7227513E+01 Qxc -0.4801912E+01 3,-1 57 3 -1 3.821239 1.895539 0.770429 Rho 0.2233425E+00 |GRAD(Rho)| 0.5520007E-15 GRAD(Rho)x 0.3851628E-15 GRAD(Rho)y 0.1263096E-15 GRAD(Rho)z 0.3747003E-15 Laplacian 0.7809639E+00 (-1/4)Del**2(Rho)) -0.1952410E+00 Diamond 0.2564995E+01 Metallicity 0.7254393E+01 Ellipticity 0.5083737E-02 Gb(Abramov) 0.3662198E+00 Vb(Abramov) -0.5371986E+00 Hb(Abramov) -0.1709788E+00 Ex_ueg -0.1000799E+00 Ec_ueg -0.1329523E-01 Delta_ex -0.9279458E-01 Delta_ec 0.1795217E-01 Delta_et -0.2492381E+00 Pxc 0.7527503E+01 Qxc -0.5168989E+01 3,-1 58 3 -1 -2.928899 0.926141 0.166675 Rho 0.8028256E-01 |GRAD(Rho)| 0.5628461E-14 GRAD(Rho)x -0.4653216E-14 GRAD(Rho)y 0.3136343E-14 GRAD(Rho)z -0.4364744E-15 Laplacian 0.3369584E+00 (-1/4)Del**2(Rho)) -0.8423960E-01 Diamond 0.3270644E+00 Metallicity 0.3055429E+01 Ellipticity 0.3132154E-01 Gb(Abramov) 0.9905776E-01 Vb(Abramov) -0.1138759E+00 Hb(Abramov) -0.1481816E-01 Ex_ueg -0.2557879E-01 Ec_ueg -0.4147034E-02 Delta_ex -0.3135475E-01 Delta_ec 0.1008035E-01 Delta_et -0.1197327E+00 Pxc 0.6167972E+01 Qxc -0.3110484E+01 3,-1 59 3 -1 0.790752 2.907602 0.246779 Rho 0.1415018E+00 |GRAD(Rho)| 0.6154314E-13 GRAD(Rho)x -0.2401234E-13 GRAD(Rho)y 0.5145119E-13 GRAD(Rho)z 0.2374322E-13 Laplacian 0.6043595E+00 (-1/4)Del**2(Rho)) -0.1510899E+00 Diamond 0.1148376E+01 Metallicity 0.4381148E+01 Ellipticity 0.1337726E-01 Gb(Abramov) 0.2110511E+00 Vb(Abramov) -0.2710123E+00 Hb(Abramov) -0.5996122E-01 Ex_ueg -0.5445877E-01 Ec_ueg -0.7901748E-02 Delta_ex -0.6405226E-01 Delta_ec 0.1568092E-01 Delta_et -0.2072623E+00 Pxc 0.6891990E+01 Qxc -0.4084726E+01 3,-1 60 3 -1 -2.353188 -2.687034 -0.095118 Rho 0.9725887E-01 |GRAD(Rho)| 0.6265557E-13 GRAD(Rho)x -0.2588731E-13 GRAD(Rho)y 0.4596500E-13 GRAD(Rho)z 0.3380514E-13 Laplacian 0.3524638E+00 (-1/4)Del**2(Rho)) -0.8811594E-01 Diamond 0.4175345E+00 Metallicity 0.4021432E+01 Ellipticity 0.5400872E-01 Gb(Abramov) 0.1178027E+00 Vb(Abramov) -0.1474894E+00 Hb(Abramov) -0.2968673E-01 Ex_ueg -0.3303371E-01 Ec_ueg -0.5159305E-02 Delta_ex -0.3401422E-01 Delta_ec 0.9686590E-02 Delta_et -0.1194239E+00 Pxc 0.6402744E+01 Qxc -0.3511475E+01 3,-1 61 3 -1 2.243038 -2.719837 -1.556632 Rho 0.3167687E+00 |GRAD(Rho)| 0.3581902E-15 GRAD(Rho)x -0.1414460E-16 GRAD(Rho)y 0.2779733E-15 GRAD(Rho)z -0.2254572E-15 Laplacian -0.1571141E+01 (-1/4)Del**2(Rho)) 0.3927853E+00 Diamond 0.5485781E+01 Metallicity -0.6456072E+01 Ellipticity 0.5865043E-02 Gb(Abramov) 0.1607848E+00 Vb(Abramov) -0.7143550E+00 Hb(Abramov) -0.5535701E+00 Ex_ueg -0.1594807E+00 Ec_ueg -0.1990767E-01 Delta_ex 0.1556105E+00 Delta_ec 0.5521924E-01 Delta_et -0.1303875E+01 Pxc 0.8011018E+01 Qxc 0.2818049E+01 3,-1 62 3 -1 2.112037 -2.116273 0.545156 Rho 0.1632141E+00 |GRAD(Rho)| 0.3179103E-11 GRAD(Rho)x -0.2369573E-11 GRAD(Rho)y -0.2021362E-11 GRAD(Rho)z 0.6371121E-12 Laplacian 0.6953140E+00 (-1/4)Del**2(Rho)) -0.1738285E+00 Diamond 0.1554797E+01 Metallicity 0.4830904E+01 Ellipticity 0.3290740E-01 Gb(Abramov) 0.2558438E+00 Vb(Abramov) -0.3378591E+00 Hb(Abramov) -0.8201529E-01 Ex_ueg -0.6587622E-01 Ec_ueg -0.9294705E-02 Delta_ex -0.7620368E-01 Delta_ec 0.1719741E-01 Delta_et -0.2312991E+00 Pxc 0.7087500E+01 Qxc -0.4431114E+01 3,-1 63 3 -1 -3.353074 -1.924635 -0.413544 Rho 0.1300706E+00 |GRAD(Rho)| 0.3345557E-15 GRAD(Rho)x 0.3011372E-16 GRAD(Rho)y -0.2939814E-15 GRAD(Rho)z -0.1568298E-15 Laplacian 0.4604327E+00 (-1/4)Del**2(Rho)) -0.1151082E+00 Diamond 0.8020695E+00 Metallicity 0.4997414E+01 Ellipticity 0.1327777E+00 Gb(Abramov) 0.1726126E+00 Vb(Abramov) -0.2301171E+00 Hb(Abramov) -0.5750448E-01 Ex_ueg -0.4867326E-01 Ec_ueg -0.7180228E-02 Delta_ex -0.4795045E-01 Delta_ec 0.1243607E-01 Delta_et -0.1626616E+00 Pxc 0.6778790E+01 Qxc -0.3855755E+01 3,-1 64 3 -1 -3.265568 -2.182542 1.135778 Rho 0.2279147E+00 |GRAD(Rho)| 0.6956566E-14 GRAD(Rho)x 0.8878532E-15 GRAD(Rho)y 0.5591475E-14 GRAD(Rho)z -0.4042394E-14 Laplacian 0.7868608E+00 (-1/4)Del**2(Rho)) -0.1967152E+00 Diamond 0.2654197E+01 Metallicity 0.7447363E+01 Ellipticity 0.9174930E-03 Gb(Abramov) 0.3753117E+00 Vb(Abramov) -0.5539082E+00 Hb(Abramov) -0.1785965E+00 Ex_ueg -0.1028209E+00 Ec_ueg -0.1360769E-01 Delta_ex -0.9402092E-01 Delta_ec 0.1804512E-01 Delta_et -0.2510724E+00 Pxc 0.7556088E+01 Qxc -0.5210325E+01 3,-1 65 3 -1 -1.811927 -1.892618 0.714676 Rho 0.1606382E+00 |GRAD(Rho)| 0.6224025E-14 GRAD(Rho)x -0.6037407E-14 GRAD(Rho)y 0.1037214E-14 GRAD(Rho)z -0.1101089E-14 Laplacian 0.5570155E+00 (-1/4)Del**2(Rho)) -0.1392539E+00 Diamond 0.1253428E+01 Metallicity 0.5872557E+01 Ellipticity 0.8110116E-01 Gb(Abramov) 0.2291320E+00 Vb(Abramov) -0.3190101E+00 Hb(Abramov) -0.8987810E-01 Ex_ueg -0.6449363E-01 Ec_ueg -0.9127953E-02 Delta_ex -0.6109180E-01 Delta_ec 0.1434332E-01 Delta_et -0.1938365E+00 Pxc 0.7065508E+01 Qxc -0.4259252E+01 3,-1 66 3 -1 -3.675558 -2.575381 -1.554298 Rho 0.3361722E+00 |GRAD(Rho)| 0.1288449E-13 GRAD(Rho)x -0.1991756E-14 GRAD(Rho)y 0.3142640E-14 GRAD(Rho)z 0.1233559E-13 Laplacian -0.1709503E+01 (-1/4)Del**2(Rho)) 0.4273757E+00 Diamond 0.6319840E+01 Metallicity -0.6551586E+01 Ellipticity 0.8849992E-02 Gb(Abramov) 0.1817476E+00 Vb(Abramov) -0.7908709E+00 Hb(Abramov) -0.6091233E+00 Ex_ueg -0.1726371E+00 Ec_ueg -0.2134163E-01 Delta_ex 0.1736227E+00 Delta_ec 0.5953553E-01 Delta_et -0.1442499E+01 Pxc 0.8089220E+01 Qxc 0.2916287E+01 3,-1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 39 42 59 37 30 41 56 58 52 35 40 54 36 60 64 63 65 45 50 57 51 44 38 61 62 55 43 32 47 31 48 53 66 1 2 2 2 2 2 3 3 4 4 4 4 4 6 6 6 6 8 8 8 8 8 9 9 10 10 10 11 12 12 12 22 23 10 5 13 14 21 27 6 12 7 15 16 22 25 15 18 23 25 13 17 19 20 26 10 28 16 17 26 12 21 24 27 28 29 1.750906 1.764169 1.931610 1.761295 2.061019 1.970634 1.813263 2.136355 1.744245 1.900891 2.017526 1.772882 2.065284 2.089747 1.738042 1.969564 1.884800 1.936623 1.940940 1.745652 1.752056 2.199998 1.963916 0.999690 1.878704 2.003844 1.839209 1.756384 1.893332 1.754228 1.989108 1.743154 0.980480 1.750912 1.764185 1.931963 1.761204 2.061281 1.970822 1.813729 2.136744 1.744270 1.901295 2.018076 1.773015 2.065469 2.090081 1.738049 1.970753 1.885310 1.937104 1.941372 1.745710 1.752122 2.200626 1.964574 0.999817 1.879268 2.004057 1.839305 1.756446 1.893595 1.754281 1.989200 1.747404 0.980565 23 23 25 21 25 23 23 25 21 23 25 22 25 25 21 23 23 23 23 21 21 25 23 17 23 23 22 23 23 21 23 22 17 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 O W O Mo O Mo O Mo O W O Mo O O O O O O O O O O O O O O O H H -0.8317 2.3094 -0.8907 2.1662 -0.8560 2.2771 -0.7665 2.1124 -0.8374 2.4135 -0.7838 2.0932 -0.9673 -0.8431 -0.9481 -0.9589 -0.9505 -0.7574 -0.7722 -0.7515 -0.9359 -0.8091 -0.7780 -0.7721 -0.9003 -0.9189 -0.9545 0.3042 0.3077 1.9607 2.1237 1.9491 1.9856 1.9560 1.9551 1.9711 2.0139 1.8773 2.1129 1.9670 2.0157 1.9294 1.9576 1.9483 1.9358 1.9441 1.9733 1.9704 1.9684 1.9424 1.9686 1.8874 1.9695 1.9534 1.9533 1.9472 0.5418 0.5818 4.8370 6.1535 4.9148 6.1566 4.8678 6.1181 4.7640 6.1623 4.9277 6.1334 4.7873 6.1676 5.0110 4.8528 4.9701 4.9942 4.9743 4.7518 4.7707 4.7531 4.9611 4.8095 4.8592 4.7727 4.9151 4.9316 4.9747 0.1540 0.1105 0.0340 3.3856 0.0267 3.6916 0.0321 3.6497 0.0314 3.7114 0.0323 3.3119 0.0295 3.7235 0.0269 0.0327 0.0297 0.0290 0.0321 0.0323 0.0312 0.0299 0.0324 0.0310 0.0314 0.0299 0.0318 0.0340 0.0325 0.0000 0.0000 0.0000 14.0277 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 14.0283 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 O W O Mo O Mo O Mo O W O Mo O O O O O O O O O O O O O O O H H -0.874472 2.411663 -1.165461 3.104362 -0.904940 3.114233 -1.043916 3.094139 -0.659834 2.443273 -1.065306 3.093544 -1.109739 -0.894549 -1.174522 -1.055614 -1.104613 -1.034355 -1.052344 -1.038304 -1.120199 -0.988113 -0.717866 -1.057064 -1.179060 -1.019820 -1.103115 0.030212 0.071778 -0.756405 1.911977 -0.903319 2.298645 -0.803028 2.304932 -0.822869 2.319036 -0.805088 1.929151 -0.847729 2.318218 -0.845989 -0.781104 -0.934996 -0.833601 -0.894656 -0.790594 -0.834192 -0.828471 -0.926067 -0.803090 -0.884802 -0.833479 -0.939757 -0.850683 -0.839431 0.312209 0.365185 -0.769569 2.029935 -0.951727 2.432561 -0.815624 2.360162 -0.833429 2.466013 -0.744498 2.057521 -0.856746 2.461980 -0.912662 -0.804947 -1.050815 -0.885816 -0.958313 -0.773385 -0.862685 -0.858205 -0.923267 -0.826973 -0.948005 -0.884710 -0.973752 -0.885652 -0.997414 0.234513 0.475507 -3.66362828 -8.02896198 -1.74446123 8.99608513 -54.47305807 4.30122703 2.30851150 -55.58809017 16.46458526 110.06114824 -169.4069 226.3023 -83.7864 -196.6451 -21.7393 -245.2754 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 0 Mar09-2024 13:51:37 Nodes: 1 Procs: 1 Mar09-2024 13:51:38 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Mar09-2024 13:51:39 Nodes: 1 Procs: 1 Mar09-2024 13:51:40 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Mar09-2024 13:51:41 Nodes: 1 Procs: 1 Mar09-2024 13:51:41 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Mar09-2024 13:51:42 Nodes: 1 Procs: 24 *** (NO TITLE) *** -4 -9.01259209 -9.01309206 -9.01326784 -9.01344854 -9.01359559 -9.01361894 -9.01362374 -9.01367565 -9.01383922 -9.01364388 -9.01370706 GEOMETRY CONVERGED