%chk=000273429.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273429

0 1
O -2.032250 1.149054 2.500379
O -3.050237 -1.378385 -1.050919
O -1.513219 2.085101 -0.577406
O 0.387850 2.031624 2.349784
O 2.647883 2.212224 1.200869
O -4.732893 0.500257 -2.001013
O 5.045475 2.123791 0.209657
N -2.950773 -2.743435 1.673389
N -4.093045 2.628969 -1.532213
C -1.314606 -0.864033 1.365851
C -2.805465 -1.293705 1.364059
C -1.276438 0.678502 1.382249
C -3.575270 -0.758460 0.124244
C -0.481087 -1.356374 0.178326
C -3.446957 0.792073 0.017041
C -2.008511 1.266572 0.156756
C 0.190806 1.164195 1.524251
C 0.882012 -0.746857 0.037630
C 1.183243 0.486977 0.697979
C 1.835704 -1.371855 -0.756747
C -4.119349 1.265649 -1.265879
C 2.457890 1.051169 0.548013
C -2.619399 -3.665233 0.550542
C -4.323779 -3.039044 2.188572
C 3.142196 -0.800880 -0.915677
C 3.465768 0.424155 -0.256185
C 1.492832 -2.647543 -1.464378
C 4.147365 -1.427190 -1.722555
C 4.784852 0.941491 -0.450467
C 5.398454 -0.883800 -1.873745
C 5.744667 0.331400 -1.228178
H -0.860119 -1.244515 2.318528
H -3.257795 -0.750777 2.256914
H -4.658065 -1.019543 0.190955
H -1.045217 -1.193361 -0.779782
H -0.407957 -2.471871 0.254789
H -4.000639 1.237273 0.896395
H -1.490924 1.829943 3.013631
H -3.628602 -1.150141 -1.836259
H -2.837296 -4.702098 0.846277
H -1.532285 -3.602181 0.352408
H -3.145118 -3.446020 -0.394864
H -4.333604 -4.071458 2.577192
H -5.128230 -2.947428 1.444731
H -4.551889 -2.378961 3.040324
H 2.337404 -3.063606 -2.034114
H 1.177832 -3.427400 -0.755792
H 0.673718 -2.493321 -2.182789
H -4.458726 2.948159 -2.421452
H -3.376670 3.223598 -1.128734
H 3.889330 -2.364169 -2.223681
H 3.559339 2.625944 1.079414
H 6.150285 -1.376397 -2.493186
H 6.736799 0.747928 -1.356629
H 5.960212 2.463294 0.056597


%chk=000273429-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273429

0 1
O -2.088097 1.139757 2.520636
O -3.163489 -1.397393 -1.163431
O -1.389472 2.178290 -0.487383
O 0.355646 1.933769 2.531888
O 2.732734 2.233175 1.316036
O -4.980901 0.568630 -1.926923
O 5.065774 2.231294 0.316737
N -3.107467 -2.759176 1.605415
N -3.725592 2.519446 -1.847371
C -1.355933 -0.926314 1.360085
C -2.860144 -1.330662 1.309699
C -1.290008 0.611225 1.402248
C -3.604091 -0.741053 0.074987
C -0.454181 -1.452212 0.218060
C -3.412963 0.814873 -0.055056
C -1.960358 1.267383 0.172244
C 0.172980 1.074918 1.610039
C 0.905878 -0.769963 0.054213
C 1.206057 0.455403 0.771430
C 1.862558 -1.352870 -0.797363
C -4.093041 1.293463 -1.360987
C 2.484811 1.062853 0.639424
C -2.972440 -3.766598 0.531390
C -4.311799 -3.000525 2.423543
C 3.167886 -0.749122 -0.933767
C 3.486043 0.465881 -0.214424
C 1.563820 -2.616595 -1.590569
C 4.181057 -1.334881 -1.767403
C 4.796282 1.029579 -0.390667
C 5.443313 -0.753911 -1.899453
C 5.765369 0.448923 -1.208092
H -0.966942 -1.288383 2.331895
H -3.290370 -0.782156 2.172017
H -4.691139 -0.915746 0.205754
H -1.012451 -1.386566 -0.735933
H -0.283614 -2.527947 0.399215
H -3.968719 1.272943 0.793143
H -1.451855 1.782915 2.976741
H -3.835532 -1.132702 -1.852017
H -2.839341 -4.763036 0.997135
H -2.101642 -3.550408 -0.101131
H -3.856194 -3.812559 -0.145505
H -4.300312 -4.044545 2.789046
H -5.273904 -2.854062 1.870463
H -4.314306 -2.334561 3.304695
H 1.804194 -2.479622 -2.661237
H 2.159665 -3.477668 -1.228988
H 0.504111 -2.900979 -1.537290
H -4.172553 2.845757 -2.705234
H -2.858122 2.950396 -1.502518
H 3.962743 -2.258556 -2.307672
H 3.665688 2.555121 1.109971
H 6.199122 -1.219197 -2.540540
H 6.755606 0.907257 -1.318360
H 5.981132 2.566018 0.166269


