%chk=000266396.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266396

0 1
O -2.251714 -1.471035 -2.123003
O 1.541156 -1.687217 2.165367
O -0.824503 -3.194951 -1.649009
O -0.352324 -2.956750 1.967090
N 0.071626 0.850537 -0.352175
N -0.984506 -1.277102 -0.243415
N 0.333351 -1.445583 0.258013
C -1.284807 0.206431 -0.309778
C 1.111070 -0.158020 0.051835
C -2.148090 0.533455 0.896257
C 2.133268 -0.412947 -1.040646
C 0.257627 2.228563 -0.045215
C -1.254922 -2.102411 -1.397567
C 0.376957 -2.106095 1.535316
C -3.538393 0.583557 0.712262
C 3.245192 -1.204534 -0.705535
C -1.603880 0.748829 2.168691
C 2.006223 0.103341 -2.334461
C 1.551771 2.717423 0.236238
C -0.825647 3.129461 -0.134894
C -4.375731 0.863252 1.794842
C 4.227616 -1.465101 -1.661684
C -2.446449 1.030868 3.248407
C 2.997393 -0.157798 -3.287276
C 1.744819 4.085482 0.430543
C -0.606571 4.492216 0.063150
C -3.830947 1.089900 3.063377
C 4.106427 -0.939236 -2.953642
C 0.672916 4.978772 0.350109
C -2.812213 -2.218045 -3.254414
C 1.889870 -2.366285 3.417397
C -1.842045 -2.203501 -4.414855
C 1.009057 -1.864424 4.540397
H -1.812713 0.461543 -1.274905
H 1.632489 0.142185 1.007628
H -3.968707 0.391447 -0.270687
H 3.328989 -1.626930 0.297438
H -0.527103 0.702599 2.324431
H 1.141377 0.712332 -2.602424
H 2.408795 2.049784 0.278883
H -1.830397 2.778874 -0.355795
H -5.454539 0.899576 1.651118
H 5.086305 -2.082512 -1.403959
H -2.021429 1.202352 4.236085
H 2.899711 0.248709 -4.292378
H 2.746514 4.458398 0.645597
H -1.446159 5.184344 -0.005984
H -4.485069 1.307721 3.906103
H 4.874300 -1.143152 -3.697724
H 0.832309 6.041990 0.505629
H -3.731903 -1.633473 -3.440410
H -3.055353 -3.239752 -2.911165
H 2.948679 -2.064436 3.518442
H 1.802309 -3.456398 3.258966
H -2.288588 -2.636099 -5.317961
H -0.937224 -2.789343 -4.183766
H -1.511484 -1.185644 -4.657412
H 1.328292 -2.265543 5.510031
H -0.039079 -2.171003 4.389940
H 1.019880 -0.769920 4.610554


%chk=000266396-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266396

0 1
O -2.275800 -1.469085 -2.015898
O 1.568584 -1.994085 2.250519
O -0.639206 -3.102213 -1.537639
O -0.552140 -2.968773 1.893745
N 0.130656 0.916079 0.012492
N -0.857159 -1.130353 -0.264607
N 0.332457 -1.319363 0.459602
C -1.215612 0.314298 -0.169797
C 1.178666 -0.109434 0.251164
C -2.202373 0.583723 0.971901
C 2.169819 -0.301479 -0.902351
C 0.385756 2.296076 -0.044735
C -1.183328 -2.003314 -1.306777
C 0.343481 -2.160158 1.576671
C -3.587274 0.420610 0.723821
C 3.405685 -0.938951 -0.633747
C -1.763408 0.948034 2.265355
C 1.864168 0.100079 -2.222715
C 1.707557 2.801325 0.138102
C -0.669962 3.224997 -0.286418
C -4.523575 0.611607 1.762386
C 4.323416 -1.180948 -1.678169
C -2.699395 1.139613 3.305186
C 2.781473 -0.142268 -3.268860
C 1.955014 4.187509 0.082422
C -0.403210 4.607646 -0.343820
C -4.081090 0.971159 3.057434
C 4.012222 -0.783928 -3.000270
C 0.907276 5.105824 -0.159585
C -2.750841 -2.310405 -3.155887
C 1.732990 -2.847555 3.465908
C -1.935008 -2.030664 -4.420367
C 1.086986 -2.190392 4.688201
H -1.672715 0.608047 -1.133102
H 1.732279 0.076247 1.190215
H -3.923183 0.125637 -0.277673
H 3.633137 -1.260932 0.389689
H -0.693998 1.100590 2.449198
H 0.920625 0.619455 -2.424476
H 2.543731 2.115316 0.303775
H -1.698873 2.873511 -0.408614
H -5.593533 0.480364 1.565943
H 5.276451 -1.678029 -1.465479
H -2.353398 1.426755 4.304362
H 2.540876 0.175394 -4.289520
H 2.979867 4.549947 0.223266
H -1.232153 5.300834 -0.527939
H -4.807147 1.122063 3.864197
H 4.724537 -0.969574 -3.812008
H 1.106764 6.181385 -0.203405
H -3.807501 -2.017992 -3.267305
H -2.679286 -3.370675 -2.857472
H 2.826399 -2.937819 3.569490
H 1.287908 -3.836066 3.258201
H -2.349485 -2.609985 -5.266442
H -0.883700 -2.332847 -4.279059
H -1.970585 -0.959680 -4.686325
H 1.285566 -2.801748 5.588217
H -0.005667 -2.115785 4.557353
H 1.500061 -1.180919 4.859644


