%chk=000267445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267445

0 1
P 0.118327 -0.224389 -0.722650
O 0.107499 -0.555806 -2.152772
O 2.975377 -0.298938 0.121566
O -1.058672 2.528375 -0.298699
O -1.519498 -2.260398 0.772756
N 0.960899 -1.397334 0.283932
N 0.895557 1.305960 -0.321185
N -1.480628 -0.090383 0.001494
N 2.954738 -2.314698 1.265430
N 0.930954 3.706856 -0.282238
N -3.425101 -0.982010 1.094130
N 4.364278 -2.395410 1.355548
N 0.317168 4.954115 -0.024980
N -4.207532 -2.076838 1.530242
C 2.339207 -1.284790 0.499636
C 0.174117 2.506066 -0.281099
C -2.106020 -1.189973 0.600059
C 5.040330 -2.607482 0.037079
C -0.286760 5.054944 1.340805
C -4.488549 -3.081578 0.457020
H 0.403303 -2.184157 0.708311
H 1.948819 1.309885 -0.277960
H -1.951261 0.854116 -0.020072
H 2.522776 -3.246896 1.294301
H 1.915662 3.699195 0.006201
H -4.008713 -0.246645 0.675427
H 4.709189 -1.501110 1.760665
H -0.438640 5.088796 -0.728590
H -3.690086 -2.552631 2.297660
H 4.699322 -3.547845 -0.423371
H 6.121897 -2.711740 0.226780
H 4.892672 -1.790352 -0.689692
H -1.108714 4.344868 1.531080
H -0.679256 6.079390 1.457973
H 0.484374 4.912537 2.113640
H -5.036979 -2.612785 -0.374903
H -5.147365 -3.855535 0.885578
H -3.591589 -3.576982 0.047798


%chk=000267445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267445

0 1
P 0.086072 -0.199530 -0.896611
O 0.039625 -0.468872 -2.457788
O 3.023582 -0.219511 0.097979
O -1.179412 2.561844 -0.287357
O -1.501780 -2.406003 0.588820
N 0.975282 -1.377474 0.068159
N 0.819760 1.325538 -0.396221
N -1.474568 -0.149111 -0.075508
N 2.898871 -2.388970 0.954653
N 0.876655 3.660142 -0.146660
N -3.396675 -1.075875 0.902909
N 4.259250 -2.434304 1.360321
N 0.298952 4.942884 0.051222
N -4.158236 -2.098232 1.529182
C 2.339169 -1.275323 0.344829
C 0.102126 2.515180 -0.276695
C -2.095281 -1.275885 0.464480
C 5.214173 -2.579730 0.226326
C -0.178232 5.166664 1.442317
C -4.626321 -3.153605 0.587959
H 0.358578 -2.146484 0.401525
H 1.837921 1.225535 -0.206992
H -1.863654 0.815391 -0.044608
H 2.350851 -3.229897 1.140089
H 1.882534 3.645204 -0.319251
H -3.867574 -0.177529 0.788355
H 4.465759 -1.599080 1.927508
H -0.459098 5.073867 -0.635523
H -3.608698 -2.495824 2.304961
H 5.041458 -3.548574 -0.271266
H 6.234107 -2.588565 0.649166
H 5.133989 -1.765158 -0.520884
H -0.930410 4.421863 1.774493
H -0.626187 6.174915 1.484173
H 0.682744 5.144755 2.130892
H -5.313252 -2.703867 -0.148179
H -5.192542 -3.896963 1.176122
H -3.798433 -3.661020 0.054000


