%chk=rs_structure_ts3_trans_scrf.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                  4.50715700   -0.36494100   -0.91954700
 C                  2.97023000   -0.23911000   -0.80527100
 C                  2.26930400   -1.45359900   -1.35648500
 C                  1.81576800   -1.46221400   -2.71080600
 C                  6.81322400    0.64205300   -0.47815400
 C                  2.27899000   -2.52758000    0.90590700
 C                  1.53977900   -3.78048400    1.39761000
 C                  1.39392000   -4.65188400    0.14164800
 C                  1.13592200   -3.62888600   -0.96392400
 H                  6.98967000    0.71204600   -1.55743700
 H                  4.84717100   -1.29249000   -0.45361100
 H                  4.78724000   -0.39986200   -1.97610600
 H                  2.68526900   -0.06754300    0.23409400
 H                  2.63166100    0.62457000   -1.38319500
 H                  2.11999900   -0.59755900   -3.29687400
 H                  1.49344000   -3.97972700   -1.93776200
 H                  2.31985200   -5.20246200   -0.06304300
 H                  0.56091100   -5.35278900    0.20863000
 H                  2.08252300   -4.27664700    2.20720200
 H                  0.54689300   -3.50947700    1.76912100
 H                  3.36367900   -2.60136600    1.03282100
 H                  1.94318900   -1.62295300    1.41702100
 C                  5.25461000    0.80969500   -0.25559600
 C                  5.00976000    0.83275800    1.26734400
 C                  4.90662600    2.14459400   -0.96679800
 C                  5.16204800    2.15772100    1.99566700
 C                  4.95616300    3.43958900   -0.16794200
 C                  4.42024900    3.28534100    1.26079200
 H                  4.79918900    2.01705200    3.01736900
 H                  6.00900000    3.76288500   -0.13176000
 H                  3.34502700    3.07032600    1.23906200
 O                  4.66149700    2.14343500   -2.15739200
 O                  4.72529900   -0.19080000    1.86586400
 H                  6.23360900    2.40421800    2.05643700
 H                  4.54462200    4.22664100    1.80691200
 H                  4.40988900    4.19491500   -0.73960900
 H                  7.32845900    1.49639300   -0.01543100
 C                  7.39410100   -0.63945900    0.05531600
 C                  8.03663100   -1.53628100   -0.69430700
 H                  8.46240900   -2.43863100   -0.26382500
 H                  8.16768800   -1.39990400   -1.76594800
 H                  7.28104400   -0.81994200    1.12348200
 C                 -0.38622200   -3.26380800   -1.09209900
 O                 -1.22436300   -3.98530100   -0.55123100
 N                 -0.61140400   -2.16888800   -1.85428300
 C                 -4.34182700   -3.64640000    2.03890500
 C                 -3.75003800   -2.85363200    1.08216700
 C                 -2.71332500   -1.94193100    1.42483700
 C                 -2.28045000   -1.89624700    2.79023000
 C                 -2.91214600   -2.72719100    3.75392000
 C                 -3.92753400   -3.58095300    3.39083000
 H                 -5.12788500   -4.33946500    1.75142300
 H                 -4.05365400   -2.93337400    0.04541100
 C                 -2.10943500   -1.07470500    0.45324300
 C                 -1.21647100   -1.02633300    3.14205600
 H                 -2.57315300   -2.67590900    4.78631700
 H                 -4.40519500   -4.21284700    4.13491100
 C                 -0.60269100   -0.23888800    2.20033500
 C                 -1.06073800   -0.24895800    0.85437900
 H                 -0.87495800   -1.00253900    4.17437200
 H                  0.22734300    0.40393000    2.46833100
 C                 -6.32022000    0.92263400   -1.84176400
 C                 -5.58947200    0.33753200   -2.85115700
 C                 -4.35747600   -0.31353400   -2.58137600
 C                 -3.86610000   -0.37320900   -1.23510500
 C                 -4.64217600    0.25556100   -0.21990800
 C                 -5.83363200    0.88228300   -0.51469500
 H                 -3.95711500   -0.85668000   -4.64004200
 H                 -7.26435000    1.41438300   -2.06074800
 H                 -5.94597000    0.36513300   -3.87861400
 C                 -3.58659300   -0.90248400   -3.61835300
 C                 -2.61908900   -1.03579000   -0.95734100
 H                 -4.28420800    0.23793900    0.80317900
 H                 -6.40738200    1.34659800    0.28360100
 C                 -1.89070200   -1.60732100   -2.00869800
 C                 -2.39563900   -1.51866800   -3.34045200
 H                 -1.80495500   -1.97285200   -4.13043600
 N                 -0.38016100    0.54305900   -0.11587100
 C                 -1.50508300    3.08502200    0.35972900
 C                 -2.22596400    3.57292400   -0.73380200
 C                 -1.96778300    3.26240700    1.66438500
 C                 -3.42411000    4.24261100   -0.50841500
 H                 -1.84118400    3.44071800   -1.73938100
 C                 -3.17264400    3.93378000    1.86821700
 H                 -1.38639300    2.89608700    2.50304400
 C                 -3.92031500    4.42730600    0.79124400
 H                 -3.98539700    4.62785300   -1.35590400
 H                 -3.53503000    4.07917900    2.88275500
 C                 -5.23932500    5.12697900    1.01430000
 H                 -5.36852300    5.41899400    2.06091900
 H                 -5.32442900    6.02760100    0.39605000
 H                 -6.07776300    4.47104800    0.74626100
 H                  0.51129100   -1.61570600   -2.43967200
 H                 -0.70603400    0.38171600   -1.06697900
 O                  0.84791900    2.30506200    1.26717700
 O                  0.53056400    2.55945200   -1.25293000
 H                  1.93033100   -2.40104400   -3.25896600
 S                  0.01213700    2.18137400    0.06497600
 N                  1.95398600   -2.45460600   -0.54288700

 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 1.5 99 1.5
 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
 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

