%chk=000287247.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287247

0 1
O 3.706341 0.713431 0.033314
O -3.568977 -1.592521 -0.040165
O -2.078075 3.046010 -0.785133
O -0.180535 3.259336 0.375782
N -1.293086 -1.781899 -0.026578
C -0.007747 -1.188556 -0.020564
C 0.112991 0.231378 -0.029844
C -1.104551 1.027479 -0.070880
C 1.393382 0.814313 -0.002106
C 1.165577 -1.988009 -0.001090
C -2.493012 -1.017964 -0.046775
C -2.322575 0.443177 -0.079201
C 2.526266 0.000908 0.017011
C 2.420795 -1.407273 0.015279
C -1.425268 -3.260163 -0.008461
C -1.008331 2.518616 -0.097655
C 4.945651 -0.032162 0.084353
H 1.518589 1.903682 0.021366
H 1.087313 -3.075224 0.001235
H -3.257664 1.015615 -0.124472
H 3.309943 -2.033470 0.028353
H -0.975735 -3.687104 0.902771
H -0.962418 -3.710490 -0.901518
H -2.502029 -3.539529 -0.012604
H 5.059308 -0.647411 -0.812315
H 4.999400 -0.624213 1.002082
H 5.688079 0.778236 0.098921
H -2.051933 4.042907 -0.819505


%chk=000287247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287247

0 1
O 3.792745 0.711332 0.035373
O -3.632927 -1.610921 -0.145456
O -2.380562 3.094083 -0.294456
O -0.083559 3.301413 -0.221540
N -1.284114 -1.779430 -0.051625
C -0.010168 -1.173697 -0.029717
C 0.122360 0.264518 -0.084178
C -1.110127 1.052780 -0.162632
C 1.421853 0.834672 -0.059093
C 1.162194 -1.971020 0.046221
C -2.496124 -1.035619 -0.126803
C -2.337339 0.415911 -0.181199
C 2.569961 0.024456 0.017239
C 2.440539 -1.388634 0.070073
C -1.411694 -3.249690 0.003095
C -1.088988 2.550094 -0.225459
C 5.018255 -0.086578 0.115190
H 1.539632 1.918760 -0.099300
H 1.084022 -3.059478 0.087172
H -3.265019 0.987587 -0.239336
H 3.319053 -2.037563 0.129396
H -0.977920 -3.646810 0.937945
H -0.911805 -3.719402 -0.862597
H -2.487321 -3.479816 -0.027500
H 5.123441 -0.755236 -0.761692
H 5.051287 -0.685126 1.046704
H 5.836885 0.647600 0.119354
H -2.302862 4.084912 -0.333578


