%chk=000287269.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287269

0 1
O -0.326538 0.380370 0.080423
N -1.594819 -0.244972 2.056814
C 0.972110 0.015424 0.624529
C 0.907730 0.105522 2.164880
C -0.314394 -0.642043 2.718980
C -1.455167 -0.399905 0.588064
C 1.353393 -1.357816 0.080975
C 1.910057 1.093530 0.089677
C -2.660664 0.082296 -0.190982
C -2.042733 1.116043 2.471212
C 0.984160 -1.679420 -1.235125
C 3.292228 0.864693 0.036918
C 2.078568 -2.285451 0.838448
C 1.393532 2.330068 -0.321350
C -3.918994 -0.465671 0.103621
C -2.531607 1.027033 -1.216274
C 1.327838 -2.917353 -1.780961
C 4.148769 1.867891 -0.424707
C 2.423130 -3.525152 0.289384
C 2.253133 3.328841 -0.786419
C 2.048156 -3.843789 -1.018586
C 3.631739 3.100305 -0.837141
C -5.040081 -0.065080 -0.626313
C -3.657437 1.423431 -1.944651
C -4.911076 0.879003 -1.651433
H 0.852382 1.174881 2.455140
H 1.840876 -0.276022 2.616547
H -0.195314 -1.740454 2.577864
H -0.405925 -0.475537 3.812657
H -1.249549 -1.478843 0.362565
H -1.405373 1.930230 2.092160
H -2.081808 1.174807 3.568717
H -3.066853 1.281773 2.094712
H 0.422592 -0.949150 -1.823454
H 3.702254 -0.096184 0.345883
H 2.380141 -2.049487 1.858253
H 0.315060 2.500884 -0.280952
H -4.017842 -1.195519 0.907894
H -1.548475 1.446543 -1.442672
H 1.036586 -3.160457 -2.801506
H 5.221222 1.686811 -0.465989
H 2.985339 -4.242577 0.884276
H 1.847375 4.285752 -1.109239
H 2.316404 -4.808779 -1.444120
H 4.300814 3.878638 -1.198172
H -6.015880 -0.489202 -0.397260
H -3.554890 2.157019 -2.742032
H -5.786066 1.187775 -2.219656


%chk=000287269-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287269

0 1
O -0.335266 0.524547 0.026335
N -1.603908 -0.120667 2.040310
C 0.985342 0.090884 0.583773
C 0.896268 0.168144 2.142793
C -0.345295 -0.587176 2.689887
C -1.474373 -0.287004 0.594117
C 1.325408 -1.313976 0.035147
C 2.003169 1.138242 0.090771
C -2.729456 0.068341 -0.190154
C -2.055485 1.215483 2.499550
C 1.014293 -1.600086 -1.320596
C 3.381305 0.821374 -0.003041
C 1.984895 -2.308635 0.799094
C 1.581483 2.460057 -0.200591
C -3.979296 -0.431832 0.256622
C -2.673814 0.828196 -1.382348
C 1.346351 -2.844743 -1.893954
C 4.321621 1.807131 -0.376989
C 2.320139 -3.558559 0.227010
C 2.521466 3.443728 -0.581377
C 2.002728 -3.832464 -1.121325
C 3.895981 3.123589 -0.667716
C -5.157382 -0.169970 -0.475398
C -3.854932 1.090166 -2.114988
C -5.099385 0.592545 -1.666335
H 0.827074 1.237396 2.411976
H 1.827123 -0.208805 2.604195
H -0.248202 -1.673666 2.502924
H -0.430727 -0.442926 3.781838
H -1.217554 -1.353953 0.418449
H -1.371226 2.044848 2.214979
H -2.148748 1.196684 3.599668
H -3.048043 1.433746 2.073507
H 0.501315 -0.835062 -1.913266
H 3.720953 -0.200527 0.199065
H 2.245147 -2.122013 1.846554
H 0.515539 2.698130 -0.143340
H -4.014849 -1.016478 1.182993
H -1.707007 1.208914 -1.722581
H 1.095312 -3.045342 -2.941646
H 5.383521 1.545349 -0.448391
H 2.828239 -4.315084 0.835936
H 2.180597 4.459857 -0.811468
H 2.261850 -4.800483 -1.564574
H 4.624528 3.887325 -0.962674
H -6.117716 -0.560950 -0.120165
H -3.801704 1.681731 -3.036214
H -6.013176 0.794693 -2.236759


