%chk=000269977.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269977

0 1
O -6.275607 3.682752 0.150092
N -0.462399 -1.530871 -0.534907
N -1.678511 -1.549716 0.133194
C 4.326712 -0.106664 -0.367319
C 2.965340 -0.049061 0.338817
C 5.404776 0.636096 0.433503
C 1.889872 -0.793655 -0.462136
C 6.765931 0.579387 -0.272627
C 0.533265 -0.726626 0.254072
C 7.845816 1.321471 0.527473
C -5.043757 -1.036462 0.082946
C -4.614173 0.362327 0.545056
C -3.990776 -2.100113 0.424525
C -5.651812 1.419121 0.158729
C -2.761063 -1.986889 -0.447160
C 9.202823 1.268426 -0.170919
C -5.231701 2.809407 0.636078
C -2.901636 -2.387807 -1.886285
H 4.244832 0.328807 -1.381772
H 4.628995 -1.161596 -0.515992
H 3.049981 -0.487099 1.352863
H 2.664082 1.005636 0.489608
H 5.488646 0.198720 1.447223
H 5.102859 1.690419 0.584413
H 1.813550 -0.367341 -1.480387
H 2.184613 -1.854270 -0.601039
H 7.069718 -0.474365 -0.423596
H 6.684624 1.015971 -1.286511
H 0.212362 0.326680 0.398593
H 0.605217 -1.176325 1.271190
H 7.930350 0.883562 1.541371
H 7.544325 2.376505 0.678221
H -6.004569 -1.310716 0.561360
H -5.240250 -1.031106 -1.006800
H -3.627716 0.612197 0.105698
H -4.456851 0.361304 1.641567
H -4.422524 -3.114837 0.308256
H -3.709963 -2.021543 1.498268
H -6.646441 1.172369 0.581478
H -5.804468 1.442780 -0.939355
H -0.505706 -1.204054 -1.513422
H 9.163843 1.728705 -1.164694
H 9.549508 0.236981 -0.301504
H 9.966724 1.800265 0.407162
H -5.187078 2.881279 1.736318
H -4.270931 3.132715 0.198982
H -2.729202 -1.538736 -2.560661
H -2.178190 -3.175007 -2.147701
H -3.899023 -2.781827 -2.117608
H -6.122318 4.593107 0.459141


%chk=000269977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269977

0 1
O -6.960977 3.515789 0.185141
N -0.469708 -1.214511 -0.423516
N -1.655361 -1.427842 0.269460
C 4.467809 -0.123441 -0.320617
C 3.089873 0.064960 0.353173
C 5.609632 0.629898 0.398303
C 1.955332 -0.692559 -0.372078
C 6.986659 0.440117 -0.277249
C 0.586901 -0.503839 0.311658
C 8.130699 1.193107 0.439655
C -5.160311 -1.134319 0.084461
C -4.892890 0.321507 0.525952
C -3.983821 -2.100426 0.403967
C -6.049189 1.276135 0.152950
C -2.725086 -1.826571 -0.397256
C 9.501656 0.997842 -0.243616
C -5.801029 2.713145 0.617183
C -2.736972 -2.050502 -1.901981
H 4.410266 0.219946 -1.374941
H 4.710669 -1.205856 -0.359582
H 3.146692 -0.280542 1.406277
H 2.846855 1.147385 0.393208
H 5.668379 0.286797 1.452493
H 5.367308 1.712759 0.437375
H 1.900300 -0.338496 -1.424176
H 2.187356 -1.774785 -0.413656
H 7.230481 -0.642382 -0.316070
H 6.929204 0.782888 -1.331783
H 0.363699 0.584351 0.409335
H 0.605982 -0.921081 1.333877
H 8.188280 0.850026 1.492917
H 7.886469 2.274536 0.478422
H -6.074556 -1.507955 0.589080
H -5.377272 -1.154195 -1.003925
H -3.947100 0.674242 0.067267
H -4.726933 0.339851 1.623279
H -4.320606 -3.141220 0.211586
H -3.727805 -2.029051 1.477393
H -6.997235 0.919988 0.601556
H -6.196754 1.281665 -0.944958
H -0.503134 -1.055126 -1.441043
H 9.477806 1.359821 -1.288981
H 9.784124 -0.071761 -0.266587
H 10.301724 1.547160 0.286127
H -5.691961 2.741732 1.723814
H -4.862442 3.103318 0.164730
H -2.563023 -1.111613 -2.470929
H -1.941319 -2.763441 -2.202964
H -3.704496 -2.459760 -2.234503
H -6.842076 4.452611 0.483572


