%chk=000212551.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212551

0 1
S 0.086695 2.323773 1.331564
F 5.686493 -1.279362 0.558563
F 4.304394 -2.704926 -0.156495
F 5.046268 -1.205645 -1.450796
N -1.138294 -0.751354 -0.543892
N -2.690585 -3.160587 -0.042351
C -0.064148 0.078217 -1.201502
C -2.050624 -1.334554 -1.586531
C -0.601182 -1.857320 0.315231
C -3.227625 -2.046378 -0.891055
C -1.773677 -2.590422 0.999029
C -0.656544 1.452814 -1.613731
C 1.147721 0.243306 -0.304050
C -1.761835 1.897919 -0.704985
C 1.237463 1.125488 0.775729
C 2.261682 -0.567726 -0.601286
C -3.808848 -3.911352 0.602688
C -1.514019 2.188099 0.640364
C 3.427938 -0.503103 0.164516
C 2.409930 1.184997 1.556184
C -3.079198 2.011906 -1.185728
C 3.501731 0.378485 1.255511
C -2.550396 2.537684 1.515120
C -4.113281 2.386667 -0.327216
C 4.584079 -1.389504 -0.200576
C -3.853412 2.642291 1.025149
H 0.287833 -0.413329 -2.154982
H -1.528965 -2.049788 -2.260215
H -2.448213 -0.509501 -2.213757
H 0.042769 -1.415633 1.106810
H 0.015967 -2.585125 -0.254734
H -1.014789 1.389602 -2.661275
H 0.151038 2.217219 -1.639259
H -3.821551 -1.305079 -0.312120
H -3.898222 -2.484395 -1.659836
H -1.371627 -3.430145 1.604976
H -2.289998 -1.894030 1.695932
H 2.204463 -1.258721 -1.447280
H -3.388420 -4.747209 1.184972
H -4.441538 -4.354999 -0.182678
H -4.449207 -3.313766 1.267841
H 2.473715 1.867576 2.409467
H -3.294773 1.804387 -2.231500
H 4.401123 0.440130 1.870950
H -2.350026 2.729680 2.570548
H -5.129450 2.476198 -0.709001
H -4.665558 2.919608 1.693791


%chk=000212551-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212551

0 1
S -0.259927 1.647188 1.808713
F 5.990056 -0.335169 0.034036
F 4.964431 -2.348069 0.175346
F 4.885802 -1.183780 -1.764658
N -1.131895 -0.934762 -0.421839
N -2.822606 -3.263786 0.019670
C -0.081579 -0.115483 -1.091862
C -2.234380 -1.286885 -1.357244
C -0.603488 -2.173070 0.213649
C -3.353236 -2.038439 -0.618966
C -1.727777 -2.913635 0.953733
C -0.640622 1.270333 -1.577313
C 1.151566 0.077238 -0.216706
C -1.735005 1.888188 -0.723732
C 1.157941 0.846753 0.979049
C 2.370055 -0.501078 -0.641097
C -3.877619 -4.073112 0.656809
C -1.658753 2.057666 0.681250
C 3.563271 -0.352094 0.097247
C 2.361037 0.997918 1.722430
C -2.917765 2.341171 -1.370036
C 3.556655 0.398276 1.296290
C -2.730712 2.643800 1.403604
C -3.984019 2.937421 -0.666954
C 4.818014 -1.029157 -0.357240
C -3.889614 3.084540 0.735320
H 0.278205 -0.641901 -2.015671
H -1.855174 -1.927533 -2.193776
H -2.658131 -0.364642 -1.788442
H 0.183265 -1.900142 0.936898
H -0.156483 -2.862610 -0.545925
H -1.032352 1.155483 -2.603878
H 0.221291 1.961075 -1.657357
H -3.811115 -1.344929 0.132268
H -4.138761 -2.325343 -1.343484
H -1.321840 -3.844557 1.392227
H -2.092137 -2.264109 1.790611
H 2.377469 -1.082840 -1.569281
H -3.438301 -5.001121 1.065024
H -4.634509 -4.356207 -0.096936
H -4.402874 -3.542606 1.491801
H 2.356204 1.603813 2.634626
H -2.989505 2.220908 -2.458491
H 4.476429 0.532514 1.873208
H -2.654256 2.758134 2.491193
H -4.875473 3.279245 -1.203083
H -4.706490 3.537488 1.307072


