%chk=000230023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230023

0 1
O -0.467627 -1.061226 -1.754434
O 5.304335 -0.262230 0.777455
N -0.481476 1.699371 -1.054730
C -0.190755 -1.169683 -0.355794
C -1.056782 -0.157681 0.481956
C -0.597369 -2.623540 -0.017923
C 1.287818 -0.910194 -0.088136
C -2.547263 -0.365216 0.309949
C -0.732391 1.301165 0.222985
C 0.304699 -3.647742 -0.697044
C 1.792808 -0.948715 1.224549
C 2.163807 -0.667074 -1.151573
C -3.150440 -0.316087 -0.954956
C -3.339890 -0.598465 1.445310
C -0.717949 2.216500 1.298702
C 3.141030 -0.726895 1.477187
C 3.526002 -0.439167 -0.929281
C 3.998333 -0.468772 0.387060
C -4.529376 -0.499111 -1.082645
C -4.719265 -0.779713 1.312540
C -0.436555 3.557934 1.041954
C -5.317211 -0.729722 0.049651
C -0.206421 3.010072 -1.289226
C -0.175028 3.971058 -0.269636
C 6.284820 -0.001845 -0.254998
H -0.795829 -0.368446 1.557001
H -1.645278 -2.775029 -0.356811
H -0.594488 -2.774233 1.076237
H 0.347428 -3.462984 -1.780454
H 1.332645 -3.600222 -0.318906
H -0.065439 -4.666327 -0.544970
H -0.388917 -0.118862 -2.064581
H 1.123691 -1.159678 2.059036
H 1.778413 -0.662713 -2.175053
H -2.531580 -0.150376 -1.841077
H -2.886970 -0.639911 2.433041
H -0.928106 1.880456 2.310847
H 3.547712 -0.750675 2.484592
H 4.185459 -0.249688 -1.768193
H -4.989903 -0.463240 -2.068599
H -5.328767 -0.960635 2.195852
H -0.420155 4.281067 1.857817
H -6.390868 -0.870980 -0.051967
H -0.009479 3.276808 -2.333983
H 0.047276 5.010516 -0.493676
H 6.039896 0.921388 -0.787577
H 6.359067 -0.856903 -0.932987
H 7.204536 0.114847 0.332790


%chk=000230023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230023

0 1
O -0.403110 -0.871432 -1.845583
O 5.400016 -0.394556 1.034181
N -0.614454 1.689323 -1.228211
C -0.175032 -1.105542 -0.418265
C -1.065935 -0.096547 0.440222
C -0.599120 -2.573203 -0.143518
C 1.314351 -0.886022 -0.053102
C -2.575256 -0.363896 0.359937
C -0.751534 1.361652 0.099076
C 0.222800 -3.600053 -0.947932
C 1.776141 -1.030709 1.284366
C 2.267117 -0.582486 -1.050017
C -3.318387 -0.157282 -0.832408
C -3.259571 -0.829139 1.512229
C -0.629921 2.350699 1.105753
C 3.132395 -0.861647 1.614360
C 3.636435 -0.407271 -0.740076
C 4.070193 -0.544174 0.599984
C -4.706194 -0.416423 -0.865494
C -4.648474 -1.088210 1.481234
C -0.378240 3.689872 0.741045
C -5.378449 -0.882055 0.288823
C -0.365718 2.982064 -1.577131
C -0.246214 4.018731 -0.628105
C 6.407840 -0.094123 0.016642
H -0.772760 -0.244514 1.495810
H -1.667157 -2.666647 -0.410389
H -0.511985 -2.781342 0.942196
H 0.164279 -3.366146 -2.024440
H 1.287000 -3.593242 -0.651130
H -0.171427 -4.620578 -0.788336
H -0.459795 0.145560 -1.948764
H 1.075628 -1.296167 2.086220
H 1.922776 -0.503276 -2.085841
H -2.808126 0.192793 -1.733774
H -2.698607 -0.996145 2.441002
H -0.733113 2.065917 2.157543
H 3.490250 -0.975593 2.642432
H 4.343154 -0.176066 -1.543222
H -5.264606 -0.257319 -1.795197
H -5.157311 -1.449333 2.382327
H -0.282960 4.464101 1.509744
H -6.455777 -1.080768 0.259271
H -0.259608 3.180314 -2.649122
H -0.051846 5.045083 -0.953149
H 6.200396 0.871141 -0.486014
H 6.468279 -0.899047 -0.742028
H 7.359836 -0.029098 0.564153


