%chk=rs00_ts3_trans_freq_hou_freq_hou_scrfm062x.chk
%nproc=8
%mem=19800MB
#p rm062x/6-31+g(d,p) int=ultrafine scrf=(solvent=cyclohexanone,smd) geom=connectivity

Title Card Required

0 1
 C                  5.82731300    0.55988700    0.28263600
 C                  4.48940400    0.09752900    0.89647500
 C                  3.44188300    1.19807500    0.95301100
 C                  3.28712800    1.92025500    2.08259700
 C                  8.23848500    0.09424400   -0.40979400
 C                  3.04170300    0.98220100   -1.54116800
 C                  1.80088200    1.31308700   -2.36959300
 C                  1.32336200    2.62790000   -1.73429000
 C                  1.66716800    2.46906500   -0.22611400
 H                  8.58698400    0.85252100    0.30100300
 H                  5.66644900    0.95517300   -0.72201900
 H                  6.22153300    1.37718500    0.89404500
 H                  4.09892300   -0.76079000    0.33982200
 H                  4.67193800   -0.23524500    1.92129600
 H                  3.90631600    1.69974600    2.94493700
 H                  2.10331200    3.39556900    0.16812200
 H                  1.88871400    3.47301000   -2.14282700
 H                  0.26189800    2.83281700   -1.89502700
 H                  2.02565600    1.41226500   -3.43574400
 H                  1.04478200    0.52868100   -2.25263000
 H                  3.89604500    1.58986600   -1.88209500
 H                  3.34143300   -0.06600900   -1.59633900
 C                  6.91139100   -0.53382800    0.19020500
 C                  6.49019600   -1.68004800   -0.75289200
 C                  7.32165400   -1.04026600    1.59492700
 C                  7.21123400   -3.01565100   -0.62085600
 C                  8.00417800   -2.39949600    1.69964200
 C                  7.30827000   -3.46705800    0.84414400
 H                  6.68022400   -3.74018300   -1.24409600
 H                  9.04549400   -2.28603800    1.36154500
 H                  6.30180800   -3.66002600    1.23815300
 O                  7.14361100   -0.34868800    2.57886400
 O                  5.62875400   -1.51457900   -1.59772700
 H                  8.22548200   -2.90830000   -1.03450200
 H                  7.85570900   -4.41350400    0.90774000
 H                  8.03676400   -2.67049700    2.75849700
 H                  9.01400600   -0.68338200   -0.45049800
 C                  8.07883300    0.70777600   -1.77449800
 C                  8.36611200    1.97788500   -2.06249400
 H                  8.25956700    2.37113600   -3.06978000
 H                  8.72308500    2.67222400   -1.30448600
 H                  7.71685900    0.05105100   -2.56493800
 C                  0.39550000    2.22578000    0.60677500
 O                 -0.29457000    3.15278000    0.99769000
 N                  0.09874800    0.89472200    0.79186800
 C                 -4.08633500    4.48567700    0.99870500
 C                 -3.47573300    3.25365600    1.05972500
 C                 -3.25807600    2.48443600   -0.11692300
 C                 -3.66413000    3.04388400   -1.37204900
 C                 -4.28949900    4.31872000   -1.40089200
 C                 -4.50499800    5.02539500   -0.24069200
 H                 -4.23632600    5.05643900    1.91113600
 H                 -3.13048900    2.86728500    2.01113000
 C                 -2.66167400    1.17971100   -0.08153000
 C                 -3.41293900    2.31245500   -2.56134400
 H                 -4.59213000    4.72668400   -2.36272100
 H                 -4.98411200    6.00022100   -0.27294000
 C                 -2.80119300    1.08533500   -2.52646200
 C                 -2.44561300    0.50126100   -1.28029900
 H                 -3.69599500    2.74901900   -3.51630100
 H                 -2.58154200    0.54275300   -3.43784400
 C                 -5.28516000   -1.07058400    3.81162700
 C                 -3.95621000   -1.16909400    4.15427600
 C                 -2.94294600   -0.64418400    3.30897200
 C                 -3.31168200    0.00550000    2.08407800
 C                 -4.69446300    0.07441600    1.75533600
 C                 -5.65273600   -0.44673700    2.59650100
 H                 -1.29126300   -1.24698300    4.57563200
 H                 -6.05169300   -1.47212400    4.46894900
 H                 -3.65855000   -1.65202300    5.08213000
 C                 -1.56847900   -0.75592000    3.64611200
 C                 -2.28997700    0.54143800    1.22389400
 H                 -4.99139000    0.54599300    0.82570600
 H                 -6.70244000   -0.37513400    2.32420400
 C                 -0.95803600    0.41105100    1.60871300
 C                 -0.60343900   -0.24208800    2.81940400
 H                  0.44930500   -0.29881900    3.08202800
 N                 -1.79519000   -0.76399400   -1.27603800
 C                 -4.02064800   -2.47239500   -1.56062400
 C                 -4.21351800   -3.30058700   -0.45108200
 C                 -5.10521100   -1.89650600   -2.22290800
 C                 -5.50809500   -3.54526400   -0.00510000
 H                 -3.35969200   -3.75776500    0.03770000
 C                 -6.39546200   -2.15115300   -1.75809400
 H                 -4.94192300   -1.27630500   -3.09703100
 C                 -6.61794700   -2.97272500   -0.64608500
 H                 -5.66117500   -4.19380800    0.85404800
 H                 -7.24333500   -1.70832500   -2.27460100
 C                 -8.01533400   -3.24237800   -0.14137400
 H                 -8.21962000   -4.31850400   -0.08999300
 H                 -8.15346000   -2.84078100    0.87041800
 H                 -8.77110400   -2.78678100   -0.78810500
 H                  0.88530600    0.27781900    0.61156900
 H                 -1.48879100   -1.06083900   -0.35294800
 O                 -2.42165200   -1.78572800   -3.53947300
 O                 -1.48084900   -3.20606300   -1.62709800
 H                  2.56789700    2.72330200    2.19208200
 S                 -2.35057300   -2.13623500   -2.12058500
 N                  2.62435100    1.35576200   -0.17679100

 1 2 1.0 11 1.0 12 1.0 23 1.0
 2 3 1.0 13 1.0 14 1.0
 3 4 2.0 99 1.0
 4 15 1.0 97 1.0
 5 10 1.0 23 1.0 37 1.0 38 1.0
 6 7 1.0 21 1.0 22 1.0 99 1.0
 7 8 1.0 19 1.0 20 1.0
 8 9 1.0 17 1.0 18 1.0
 9 16 1.0 43 1.0 99 1.0
 10
 11
 12
 13
 14
 15
 16
 17
 18
 19
 20
 21
 22
 23 24 1.0 25 1.0
 24 26 1.0 33 2.0
 25 27 1.0 32 2.0
 26 28 1.0 29 1.0 34 1.0
 27 28 1.0 30 1.0 36 1.0
 28 31 1.0 35 1.0
 29
 30
 31
 32
 33
 34
 35
 36
 37
 38 39 2.0 42 1.0
 39 40 1.0 41 1.0
 40
 41
 42
 43 44 2.0 45 1.5
 44
 45 75 1.0 93 1.0
 46 47 2.0 51 1.5 52 1.0
 47 48 1.5 53 1.0
 48 49 1.5 54 1.5
 49 50 1.5 55 1.5
 50 51 2.0 56 1.0
 51 57 1.0
 52
 53
 54 59 1.5 72 1.0
 55 58 2.0 60 1.0
 56
 57
 58 59 1.5 61 1.0
 59 78 1.0
 60
 61
 62 63 2.0 67 1.5 69 1.0
 63 64 1.5 70 1.0
 64 65 1.5 71 1.5
 65 66 1.5 72 1.5
 66 67 2.0 73 1.0
 67 74 1.0
 68 71 1.0
 69
 70
 71 76 2.0
 72 75 1.5
 73
 74
 75 76 1.5
 76 77 1.0
 77
 78 94 1.0 98 1.0
 79 80 1.5 81 1.5 98 1.0
 80 82 1.5 83 1.0
 81 84 1.5 85 1.0
 82 86 1.5 87 1.0
 83
 84 86 1.5 88 1.0
 85
 86 89 1.0
 87
 88
 89 90 1.0 91 1.0 92 1.0
 90
 91
 92
 93
 94
 95 98 2.0
 96 98 2.0
 97
 98
 99

