%nprocshared=12 %lindaworkers=maginet132,maginet131 %mem=15000MB #p freq rb3lyp/genecp scrf=check guess=tcheck geom=(connectivity,allcheck) genchk Title Card Required 0 1 Pd 0.81906500 0.02261100 0.26501500 C 1.90521000 -1.69202900 1.28197200 C 2.84608500 -1.79554400 0.24910200 C 0.52033700 -1.98628000 1.07817400 H 2.24421700 -1.42727000 2.27859400 P -1.29988300 0.78850000 -0.31972200 O -1.35843500 2.38972700 -0.67546300 O -2.11528900 0.28320300 -1.67887100 O -2.40666000 0.66884100 0.87683600 C -2.76329300 -0.96042100 -1.65079000 C -3.76902400 0.98325500 0.69215900 C -3.88655200 -1.05335300 -0.80869300 C -2.33218300 -2.00975300 -2.48157200 C -4.48831900 0.19205600 -0.22145200 C -4.35521500 2.00234400 1.46451000 C -4.48267100 -2.31626200 -0.59934600 C -2.98939000 -3.23151300 -2.27645200 C -1.28450600 -1.83980300 -3.60633400 C -5.81070600 0.56682700 -0.55343900 C -5.68665200 2.29610500 1.13779900 C -3.65359000 2.71092500 2.64802500 C -4.00361500 -3.41880100 -1.33335000 H -2.69675300 -4.09075400 -2.86753700 C -1.21685600 -3.09055900 -4.50925600 C -1.68431600 -0.64976100 -4.51435200 C 0.13243900 -1.61147500 -3.03326900 C -6.40235100 1.64431500 0.13126300 H -6.19865100 3.08139200 1.68028600 C -4.62166300 3.64856700 3.40277100 C -2.46243000 3.57460200 2.17627600 C -3.15908600 1.65227200 3.66440300 H -0.87315900 -3.97718500 -3.96579900 H -2.18662700 -3.31957200 -4.96538600 H -0.50349900 -2.90663500 -5.32028700 H -2.67492000 -0.81491900 -4.95454200 H -1.70693800 0.29461100 -3.96716000 H -0.96392800 -0.55243700 -5.33569400 H 0.18234400 -0.72863100 -2.39049000 H 0.46318000 -2.47832400 -2.44964000 H 0.84623600 -1.46954000 -3.85485400 C -7.81249500 2.08804100 -0.18594400 H -4.09540000 4.08655800 4.25808400 H -4.97231500 4.47629400 2.77591700 H -5.49600800 3.11443600 3.79093900 H -2.03910200 4.11479100 3.03216900 H -1.67276700 2.97128400 1.73056200 H -2.78269100 4.31467000 1.43377500 H -3.99709000 1.05373900 4.04066000 H -2.42586900 0.97311400 3.22525800 H -2.69134200 2.15191700 4.52194100 C -4.60008400 -4.79580900 -1.14744200 C -5.60120200 -2.52352900 0.39688200 H -6.54974800 -2.76375000 -0.10118800 H -5.37302100 -3.36840700 1.05698000 H -5.76380000 -1.64472500 1.02227900 C -6.60013200 -0.12978100 -1.63935800 H -5.99232600 -0.83410900 -2.20811300 H -7.45726300 -0.67965200 -1.22915100 H -7.00884000 0.60545400 -2.34264600 H -7.89911100 2.46208500 -1.21457000 H -8.53160500 1.26488500 -0.08999900 H -8.13034800 2.89064200 0.48617100 H -5.68453400 -4.79805900 -1.31519200 H -4.15138300 -5.51258300 -1.84130500 H -4.43802800 -5.17412700 -0.12982200 S 2.11453400 2.10288300 -0.48588700 C 0.87853100 3.48740400 -0.66039300 H 0.53540000 3.75298900 0.34290000 C -0.33024000 2.97775000 -1.49014000 H 0.01652500 2.25201200 -2.23583400 C -0.88134100 4.21824100 -2.21645700 H -1.34395800 3.96316700 -3.17467500 H -1.65435500 4.68221800 -1.58926200 C 1.33710100 4.70542100 -1.43700100 C 0.33231300 5.10909000 -2.33032400 C 2.51987100 5.43796700 -1.32570000 C 0.51338100 6.22921600 -3.14017600 C 2.70001100 6.56083800 -2.13948100 H 3.29183900 5.14781800 -0.62074600 C 1.70678700 6.95125800 -3.04429200 H -0.26183700 6.53781000 -3.83676100 H 3.62027100 7.13362000 -2.06676300 H 1.86205700 7.82302000 -3.67387800 C 3.29473400 2.68966200 0.75507600 C 4.62712700 2.88753300 0.31555100 C 2.92656700 2.89494800 2.10523300 C 5.57340100 3.32662300 1.24995500 C 3.91519600 3.33489600 2.99738400 C 5.22386600 3.55517600 2.57888600 H 6.59724600 3.48727400 0.92351400 H 3.64412700 3.50063600 4.03675400 H 5.97254100 3.89604700 3.28855400 C 1.53134300 2.67811000 2.64129200 H 0.88842100 3.55065500 2.46855300 H 1.03901400 1.81379400 2.18025600 H 1.56277300 2.51665500 3.72298200 C 5.07069400 2.63875800 -1.10954900 H 6.12416300 2.90849700 -1.22712300 H 4.96359900 1.58433800 -1.38653400 H 4.48645300 3.22335100 -1.82762800 C 3.40768000 -4.57411700 0.05618900 H 4.34704000 -4.48087900 0.58568200 C 2.26476400 -4.94453400 0.82656400 C 3.52738000 -4.56186000 -1.36595400 O 1.10564000 -5.16811800 0.46909800 O 4.59166100 -4.40386400 -1.98079100 O 2.34603800 -4.70626800 -2.06188300 O 2.60243900 -5.01842800 2.17288800 C 2.49035200 -4.77993300 -3.48088200 H 3.14116800 -5.61091900 -3.77145800 H 1.48408900 -4.94097500 -3.87214800 H 2.90547200 -3.85441400 -3.89280700 C 1.55907300 -5.45515200 3.04249600 H 1.20179000 -6.45294900 2.76500100 H 1.99960400 -5.48649800 4.04181400 H 0.70888400 -4.76675300 3.03230400 C 4.25534900 -1.42658700 0.32727100 C 5.02764900 -1.45179600 -0.85325000 C 4.88504800 -1.04947000 1.53318300 C 6.37813700 -1.11092500 -0.82976700 H 4.56802100 -1.77172300 -1.78198800 C 6.23400600 -0.71132600 1.55236600 H 4.32388200 -1.03274100 2.46191900 C 6.98606800 -0.73829600 0.37184700 H 6.95767300 -1.14375500 -1.74780800 H 6.70340000 -0.42759700 2.48991100 H 8.03987800 -0.47506900 0.39192300 C -0.43648800 -2.12718500 2.19277500 C -0.24582100 -1.51656400 3.44820300 C -1.57731100 -2.93171100 2.01135800 C -1.15597400 -1.71550800 4.48441800 H 0.61350600 -0.87371100 3.61568500 C -2.48689200 -3.13049600 3.04916900 H -1.73854300 -3.41275500 1.05069300 C -2.28056000 -2.52453700 4.29109500 H -0.98820600 -1.23719000 5.44556100 H -3.35480300 -3.76434700 2.88991200 H -2.98752600 -2.68041700 5.10110800 H 2.48644000 -2.10416100 -0.72650100 H 0.27333300 -2.57184800 0.19610700 1 6 1.0 2 3 1.5 4 1.5 5 1.0 3 117 1.0 139 1.0 4 128 1.0 140 1.0 5 6 7 1.0 8 1.0 9 1.0 7 69 1.0 8 10 1.0 9 11 1.0 10 12 1.5 13 1.5 11 14 1.5 15 1.5 12 14 1.0 16 1.5 13 17 1.5 18 1.0 14 19 1.5 15 20 1.5 21 1.0 16 22 1.5 52 1.0 17 22 1.5 23 1.0 18 24 1.0 25 1.0 26 1.0 19 27 1.5 56 1.0 20 27 1.5 28 1.0 21 29 1.0 30 1.0 31 1.0 22 51 1.0 23 24 32 1.0 33 1.0 34 1.0 25 35 1.0 36 1.0 37 1.0 26 38 1.0 39 1.0 40 1.0 27 41 1.0 28 29 42 1.0 43 1.0 44 1.0 30 45 1.0 46 1.0 47 1.0 31 48 1.0 49 1.0 50 1.0 32 33 34 35 36 37 38 39 40 41 60 1.0 61 1.0 62 1.0 42 43 44 45 46 47 48 49 50 51 63 1.0 64 1.0 65 1.0 52 53 1.0 54 1.0 55 1.0 53 54 55 56 57 1.0 58 1.0 59 1.0 57 58 59 60 61 62 63 64 65 66 67 1.0 84 1.0 67 68 1.0 69 1.0 74 1.0 68 69 70 1.0 71 1.0 70 71 72 1.0 73 1.0 75 1.0 72 73 74 75 1.5 76 1.5 75 77 1.5 76 78 1.5 79 1.0 77 80 1.5 81 1.0 78 80 1.5 82 1.0 79 80 83 1.0 81 82 83 84 85 1.5 86 1.5 85 87 1.5 97 1.0 86 88 1.5 93 1.0 87 89 1.5 90 1.0 88 89 1.5 91 1.0 89 92 1.0 90 91 92 93 94 1.0 95 1.0 96 1.0 94 95 96 97 98 1.0 99 1.0 100 1.0 98 99 100 101 102 1.0 103 1.5 104 1.5 102 103 105 2.0 108 1.0 104 106 2.0 107 1.0 105 106 107 109 1.0 108 113 1.0 109 110 1.0 111 1.0 112 1.0 110 111 112 113 114 1.0 115 1.0 116 1.0 114 115 116 117 118 1.5 119 1.5 118 120 1.5 121 1.0 119 122 1.5 123 1.0 120 124 1.5 125 1.0 121 122 124 1.5 126 1.0 123 124 127 1.0 125 126 127 128 129 1.5 130 1.5 129 131 1.5 132 1.0 130 133 1.5 134 1.0 131 135 1.5 136 1.0 132 133 135 1.5 137 1.0 134 135 138 1.0 136 137 138 139 140