%chk=000250237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250237

0 1
S 1.400488 6.216050 -0.000300
S -6.039787 -1.566263 -0.000099
S 4.424312 -4.516331 -0.001315
N 0.909071 1.176298 -0.000370
N -1.294948 0.195723 0.001046
N 0.314374 2.400155 0.000016
N -2.132925 -0.881949 0.000203
N 0.612512 -1.250648 0.000601
N 1.983611 -1.385700 0.000457
C 0.410844 4.769456 0.000063
C -4.302907 -1.815032 -0.000177
C 3.839375 -2.866686 -0.000235
C -0.912681 5.112787 0.000532
C -4.025074 -3.152735 -0.000891
C 4.897879 -1.999896 -0.000057
C 0.107362 -0.022165 0.000332
C -1.131885 6.539945 0.000602
C -5.208481 -3.981437 -0.001378
C 1.064268 3.476951 -0.000151
C -3.426076 -0.661581 0.000475
C 0.016881 7.269683 0.000174
C -6.371454 -3.275734 -0.001041
C 6.179425 -2.663179 -0.000758
C 2.408817 -2.626707 0.000302
C 6.089751 -4.022143 -0.001463
H -1.730708 4.404479 0.000832
H -3.022427 -3.567917 -0.001077
H 4.803972 -0.921501 0.000558
H -2.130881 6.957315 0.000958
H -5.138506 -5.061772 -0.001958
H 2.166203 3.486262 -0.000452
H -3.915623 0.324692 0.001177
H 7.105818 -2.103813 -0.000701
H 0.131946 8.340126 0.000123
H -7.381928 -3.645264 -0.001277
H 1.933715 1.051592 -0.000242
H -1.637935 1.169497 0.000985
H 1.754331 -3.517390 0.000078
H 6.886769 -4.745767 -0.002072


%chk=000250237-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250237

0 1
S 1.597860 5.967764 0.000425
S -6.266754 -1.303532 -0.000212
S 4.791898 -4.339073 -0.000832
N 0.827557 0.905703 -0.000111
N -1.315208 -0.028514 -0.000143
N 0.233889 2.144510 0.000069
N -2.215766 -1.068670 -0.000288
N 0.592604 -1.479254 -0.000357
N 2.010284 -1.378648 -0.000377
C 0.465764 4.546419 0.000344
C -4.511440 -1.772300 -0.000325
C 4.047547 -2.680295 -0.000546
C -0.863365 4.981392 0.000489
C -4.373765 -3.162788 -0.000550
C 5.047208 -1.700530 -0.000382
C 0.050435 -0.253901 -0.000212
C -1.006184 6.409626 0.000663
C -5.624985 -3.866609 -0.000638
C 1.020423 3.210074 0.000152
C -3.497181 -0.738217 -0.000181
C 0.204152 7.092203 0.000655
C -6.736618 -3.032628 -0.000482
C 6.381099 -2.229190 -0.000466
C 2.606495 -2.560537 -0.000523
C 6.430111 -3.618692 -0.000692
H -1.701834 4.282054 0.000470
H -3.390835 -3.638408 -0.000648
H 4.808795 -0.635017 -0.000198
H -1.972123 6.920236 0.000792
H -5.704628 -4.956349 -0.000809
H 2.121320 3.112142 0.000076
H -3.840015 0.315655 0.000020
H 7.279020 -1.606399 -0.000355
H 0.390079 8.164416 0.000765
H -7.793383 -3.292704 -0.000501
H 1.845260 0.714221 -0.000182
H -1.592321 0.968220 -0.000001
H 1.994131 -3.477511 -0.000619
H 7.297975 -4.275468 -0.000795


