%chk=000298037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298037

0 1
Cl -3.489365 1.398811 0.809913
Cl -1.398339 -3.489877 -0.807450
Cl 1.397923 3.488980 -0.812345
Cl 3.489500 -1.397378 0.810692
P -1.841699 0.996677 -0.310870
P -0.996826 -1.841368 0.312330
P 0.996837 1.841819 0.309544
P 1.841500 -0.997003 -0.310241
N -1.766200 -0.641210 -0.555312
N -0.640825 1.766347 0.555555
N 0.640936 -1.765571 0.557550
N 1.765653 0.640527 -0.557062
C -2.252570 1.796608 -1.899671
C -1.797497 -2.251163 1.901030
C 1.798270 2.253366 1.897404
C 2.252062 -1.799176 -1.897973
C -2.823584 1.034363 -2.919039
C -3.157082 -1.979636 2.063846
C 1.036947 2.824611 2.917332
C 1.980737 -3.158946 -2.059582
C -1.981150 3.156119 -2.063292
C -1.035707 -2.821471 2.921137
C 3.157985 1.982207 2.059770
C 2.822725 -1.038317 -2.918576
C -3.137864 1.655272 -4.134642
C -3.769234 -2.296067 3.281756
C 1.659014 3.139401 4.132211
C 2.297756 -3.772250 -3.276758
C -2.298406 3.767715 -3.281265
C -1.657177 -3.134943 4.136662
C 3.770739 2.299976 3.277026
C 3.136785 -1.660939 -4.133360
C -2.876295 3.017498 -4.312142
C -3.019486 -2.873263 4.313363
C 3.021455 2.878103 4.308449
C 2.875320 -3.023446 -4.308846
H -3.022050 -0.037027 -2.791892
H -3.756223 -1.522613 1.268917
H -0.034599 3.022871 2.791177
H 1.523426 -3.757354 -1.264268
H -1.523591 3.755636 -1.268953
H 0.035749 -3.020005 2.794630
H 3.756780 1.524458 1.264997
H 3.021092 0.033283 -2.793028
H -3.583246 1.075360 -4.940681
H -4.827990 -2.089614 3.426988
H 1.079832 3.584969 4.938673
H 2.091468 -4.831166 -3.421055
H -2.092068 4.826410 -3.427109
H -1.077634 -3.579802 4.943256
H 4.829609 2.093852 3.421893
H 3.581933 -1.082136 -4.940325
H -3.121640 3.498117 -5.259213
H -3.500539 -3.117966 5.260379
H 3.502976 3.123848 5.254958
H 3.120480 -3.505396 -5.255287


%chk=000298037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298037

0 1
Cl -3.059183 1.534570 1.890040
Cl -1.533534 -3.060983 -1.887858
Cl 1.533119 3.058234 -1.892462
Cl 3.060021 -1.532048 1.891071
P -1.796337 1.220606 -0.011660
P -1.220654 -1.796573 0.012977
P 1.220857 1.796293 0.010112
P 1.796528 -1.220904 -0.010652
N -1.922428 -0.355732 -0.535146
N -0.355020 1.922593 0.534929
N 0.355420 -1.922213 0.537386
N 1.922360 0.354704 -0.536406
C -2.650388 2.260332 -1.266896
C -2.261016 -2.649604 1.268373
C 2.261613 2.651009 1.264054
C 2.650246 -2.262297 -1.264738
C -3.406802 1.634140 -2.283776
C -3.666972 -2.520265 1.196364
C 1.636197 3.407343 2.281472
C 2.521462 -3.668227 -1.191261
C -2.521376 3.666347 -1.195431
C -1.635359 -3.405601 2.285890
C 3.667603 2.522570 1.191107
C 3.406199 -1.637418 -2.282769
C -4.048244 2.440911 -3.248446
C -4.460726 -3.165999 2.168038
C 2.443735 4.049252 3.245190
C 3.167683 -4.462753 -2.161980
C -3.167854 4.459606 -2.167013
C -2.442619 -4.046300 3.250643
C 4.461635 3.169515 2.161747
C 4.047384 -2.445445 -3.246557
C -3.932649 3.849358 -3.188909
C -3.851017 -3.930385 3.190561
C 3.852162 3.934209 3.184183
C 3.932004 -3.853822 -3.185017
H -3.465186 0.541695 -2.317875
H -4.126395 -1.916879 0.406971
H 0.543766 3.465310 2.316702
H 1.918150 -4.127066 -0.401474
H -1.917689 4.126200 -0.406519
H -0.542941 -3.464232 2.320393
H 4.126875 1.918986 0.401779
H 3.464426 -0.545014 -2.318395
H -4.631705 1.969503 -4.046202
H -5.550719 -3.069869 2.129088
H 1.972937 4.632649 4.043354
H 3.071986 -5.552743 -2.121888
H -3.071985 5.549637 -2.128480
H -1.971631 -4.629433 4.048887
H 5.551664 3.074093 2.122062
H 4.630481 -1.975070 -4.045189
H -4.432414 4.470332 -3.940518
H -4.472372 -4.429581 3.942234
H 4.473731 4.434331 3.935063
H 4.431571 -4.475773 -3.935950


