%chk=000191963.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191963

0 1
Cl -1.512032 1.849724 2.511463
Cl -6.926360 -2.659051 1.528566
P -3.200731 -0.914658 -1.270045
O 1.341559 1.259064 -2.006617
O -4.472734 -0.918723 -2.334760
O -1.656944 3.185066 -1.154164
O -2.505304 -2.212415 -1.147145
N 2.091447 -0.123503 -0.241402
N -2.224626 0.404944 -1.874705
N -3.974581 -0.233731 0.132609
N 2.415130 0.188708 2.020063
N 4.469713 -0.621925 -0.882884
N 5.991218 -0.571822 1.036798
N 5.277836 -0.091264 3.239945
C -0.048444 1.654715 -2.068921
C 1.439596 -0.137356 -1.563766
C -0.832753 0.366642 -1.781369
C 0.026092 -0.637735 -1.503128
C -0.294960 2.746169 -1.016883
C 3.463421 -0.301958 -0.006135
C -3.041814 0.016941 1.268180
C -5.303382 -0.792248 0.482267
C 1.510660 0.184820 1.038641
C 3.646405 -0.110691 1.408550
C -2.883037 1.536500 1.401928
C -5.273860 -2.238945 0.993177
C 4.972563 -0.255666 1.914662
C 5.688758 -0.735775 -0.290465
H -0.199007 2.025145 -3.105742
H 2.116696 -0.621061 -2.311666
H -0.189976 -1.675765 -1.280282
H -2.632116 1.367761 -1.920834
H -0.233298 2.362060 0.021101
H 0.414220 3.583908 -1.126894
H -2.045785 -0.472042 1.137566
H -3.434400 -0.401213 2.225455
H -5.970250 -0.712567 -0.415748
H -5.765590 -0.127664 1.253338
H 0.449496 0.367816 1.144126
H -3.787518 2.011467 1.824406
H -2.663167 2.042766 0.437878
H -4.592300 -2.373383 1.854060
H -4.977167 -2.973180 0.217908
H -4.380571 -1.532847 -3.112985
H -1.716248 3.934094 -1.782718
H 6.539282 -0.989940 -0.946714
H 6.221871 -0.210898 3.570285
H 4.552290 0.127719 3.904700


%chk=000191963-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191963

0 1
Cl -3.800516 2.769021 2.814153
Cl -7.564045 -2.780044 0.790442
P -3.034251 -1.039587 -0.899339
O 1.468964 1.432416 -1.589344
O -4.015839 -1.335769 -2.304704
O -1.855117 3.156572 -1.195033
O -2.193516 -2.326414 -0.465610
N 2.564916 -0.081085 -0.045115
N -2.026595 0.338659 -1.208432
N -4.267942 -0.336025 0.107050
N 3.290119 0.090982 2.127698
N 4.714513 -0.696702 -1.139251
N 6.560921 -0.851009 0.481285
N 6.279754 -0.451516 2.794242
C 0.023274 1.659965 -1.746927
C 1.699888 -0.007250 -1.225310
C -0.627029 0.357629 -1.289328
C 0.317375 -0.583606 -1.013422
C -0.415907 2.891738 -0.923966
C 3.939746 -0.365652 -0.068261
C -3.852081 0.408245 1.325688
C -5.653787 -0.869153 0.071738
C 2.238439 0.187732 1.296781
C 4.364389 -0.257878 1.281983
C -4.192723 1.900624 1.180068
C -5.758148 -2.227221 0.789825
C 5.742887 -0.518474 1.536741
C 6.012397 -0.921389 -0.770959
H -0.193032 1.848211 -2.821239
H 2.283843 -0.466755 -2.045369
H 0.137053 -1.605715 -0.681795
H -2.474500 1.257514 -1.347681
H -0.339565 2.694200 0.157023
H 0.209439 3.766667 -1.177260
H -2.767636 0.291139 1.498517
H -4.364253 -0.006600 2.214197
H -5.979635 -0.969616 -0.975134
H -6.314617 -0.133222 0.563465
H 1.224489 0.434936 1.600721
H -5.265179 2.069174 1.001841
H -3.580186 2.407434 0.420273
H -5.458476 -2.177425 1.847325
H -5.197371 -3.018165 0.269938
H -3.703962 -2.126554 -2.814696
H -1.947735 3.809971 -1.930472
H 6.702334 -1.191820 -1.575744
H 7.269997 -0.650796 2.919010
H 5.688200 -0.209385 3.586088


