%chk=000264544.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264544

0 1
S 0.043676 -2.241263 2.142005
S 0.434900 2.734060 -1.343860
O -4.069707 3.707184 0.494225
N -0.059118 0.060053 0.624631
N -3.164278 1.739493 1.268375
N -1.960155 3.163744 -0.310348
N -1.919857 -0.326459 1.924362
C -0.931241 1.149664 0.425236
C 1.273324 -0.131268 0.021113
C -2.079790 0.863375 1.239277
C -0.679237 -0.779629 1.535122
C 2.365124 0.550838 0.861993
C -0.844086 2.323881 -0.378523
C -3.137198 2.926354 0.488563
C 3.716503 0.257427 0.269861
C -4.339002 1.444655 2.124674
C -1.288671 -3.465348 1.937231
C -1.966547 4.418979 -1.113828
C -1.150476 -4.173247 0.597272
C 4.486352 -0.808580 0.758590
C 4.209263 1.047225 -0.780296
C -1.157619 -3.221178 -0.570344
C 5.740684 -1.077061 0.203367
C 5.463171 0.773384 -1.331708
C 6.231386 -0.288023 -0.841490
C -2.292758 -2.441180 -0.842631
C -0.030205 -3.114736 -1.398096
C -2.290953 -1.554817 -1.921988
C -0.035243 -2.228213 -2.479363
C -1.162073 -1.443968 -2.741103
H 1.268661 0.280502 -1.021432
H 1.473387 -1.227210 -0.074987
H 2.187080 1.649409 0.894984
H 2.314632 0.215570 1.917829
H -4.017549 1.289190 3.171010
H -4.843034 0.525652 1.776464
H -5.059179 2.284585 2.089978
H -2.278652 -2.973794 2.046392
H -1.196513 -4.176089 2.782971
H -2.910011 4.975722 -0.956097
H -1.869676 4.189258 -2.191268
H -1.121607 5.069937 -0.820959
H -1.984160 -4.902504 0.478726
H -0.228487 -4.793985 0.586596
H 4.110196 -1.426522 1.571362
H 3.612604 1.874987 -1.164689
H 6.337079 -1.902937 0.587261
H 5.843112 1.389651 -2.145178
H 7.208320 -0.497882 -1.271371
H -3.173031 -2.518311 -0.207219
H 0.852227 -3.720615 -1.201742
H -3.171327 -0.947149 -2.126200
H 0.842406 -2.149491 -3.119580
H -1.161048 -0.747521 -3.577771


%chk=000264544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264544

0 1
S 0.382836 -2.340102 1.820733
S 0.884803 3.043273 -1.223485
O -3.987117 3.528716 0.214634
N 0.290760 0.126448 0.498744
N -2.948466 1.555628 0.915329
N -1.727189 3.183148 -0.384301
N -1.670177 -0.446075 1.543205
C -0.616457 1.191857 0.280692
C 1.688922 0.005162 0.035514
C -1.803565 0.779122 0.925607
C -0.390517 -0.813470 1.260386
C 2.706244 0.596470 1.050035
C -0.514471 2.435546 -0.412829
C -2.955749 2.798850 0.248006
C 4.128075 0.439772 0.531469
C -4.172051 1.080976 1.590497
C -1.167135 -3.447606 1.931085
C -1.749183 4.496399 -1.073126
C -1.438942 -4.247671 0.635603
C 4.965036 -0.607840 0.993102
C 4.626446 1.323306 -0.462093
C -1.835511 -3.385179 -0.554507
C 6.272410 -0.768841 0.478953
C 5.932103 1.165499 -0.976857
C 6.760054 0.117978 -0.508424
C -3.174388 -2.941887 -0.708771
C -0.873809 -2.985446 -1.516752
C -3.542561 -2.111434 -1.790407
C -1.236244 -2.150790 -2.599216
C -2.572014 -1.709156 -2.738242
H 1.772989 0.544235 -0.921436
H 1.891406 -1.069009 -0.127504
H 2.460891 1.665338 1.189890
H 2.589065 0.086798 2.024709
H -3.976520 0.937195 2.666235
H -4.487036 0.117444 1.155900
H -4.951358 1.841904 1.442507
H -1.993033 -2.764330 2.187861
H -0.954735 -4.115519 2.782578
H -2.750906 4.927077 -0.941538
H -1.517869 4.359604 -2.142354
H -0.977386 5.154579 -0.641091
H -2.257783 -4.957812 0.873163
H -0.548352 -4.856216 0.392777
H 4.593074 -1.295312 1.763492
H 3.985518 2.136960 -0.824251
H 6.909650 -1.579760 0.850054
H 6.304973 1.858923 -1.739321
H 7.774281 -0.003014 -0.905517
H -3.932709 -3.251154 0.022007
H 0.162987 -3.328872 -1.416054
H -4.582636 -1.782946 -1.899035
H -0.480149 -1.848907 -3.332785
H -2.854905 -1.064059 -3.577470


