%chk=000180037.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180037

0 1
O 0.149979 0.388226 1.036610
O 0.572084 -1.865630 0.884593
O 0.046534 -0.675705 -1.026362
N 1.153767 3.055796 -0.651456
C 2.238630 -0.306411 -0.016098
C 3.765708 -0.050330 -0.234613
C 1.488420 0.844443 0.723547
C 1.992453 -1.567807 0.854664
C 1.464075 -0.549940 -1.331981
C -0.235219 -0.819628 0.354973
C 4.002315 1.221659 -1.064185
C 4.469279 0.105877 1.126470
C 4.384742 -1.246330 -0.984261
C -1.699590 -1.117321 0.604753
C -2.600819 -0.090196 -0.089247
C 1.319930 2.078573 -0.060652
C -4.080348 -0.402983 0.150835
C -4.981874 0.635165 -0.541978
C -6.378774 0.350154 -0.327530
C -7.547285 0.114670 -0.150190
H 1.937105 1.078510 1.721370
H 2.453811 -2.478355 0.433984
H 2.292727 -1.434829 1.907622
H 1.514711 0.294581 -2.040977
H 1.747217 -1.491207 -1.832471
H 3.829280 2.137611 -0.487981
H 3.368371 1.269395 -1.956396
H 5.041035 1.276839 -1.414305
H 4.444649 -0.814625 1.718376
H 5.528528 0.360028 0.989372
H 4.033010 0.906482 1.732522
H 4.006457 -1.330996 -2.008635
H 5.474015 -1.138450 -1.060626
H 4.197758 -2.200614 -0.480247
H -1.917589 -2.146690 0.246318
H -1.877962 -1.123858 1.702082
H -2.376079 -0.076372 -1.176660
H -2.352363 0.926998 0.279541
H -4.299290 -0.419701 1.236873
H -4.325314 -1.416866 -0.222813
H -4.764251 0.660396 -1.635531
H -4.742548 1.658360 -0.167870
H -8.547886 -0.084722 0.000359


%chk=000180037-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180037

0 1
O 0.148429 0.364205 1.090632
O 0.580653 -1.957979 0.796872
O 0.055284 -0.609223 -1.095017
N 0.927940 2.942973 -1.039761
C 2.262627 -0.317577 -0.026110
C 3.811763 -0.050420 -0.211862
C 1.452922 0.887465 0.587872
C 1.986929 -1.494615 0.963860
C 1.525114 -0.698657 -1.340898
C -0.231809 -0.846220 0.313536
C 4.088661 1.304657 -0.921854
C 4.529004 -0.028557 1.169728
C 4.444735 -1.180284 -1.076311
C -1.704546 -1.139456 0.524697
C -2.633756 -0.073953 -0.094801
C 1.179137 2.013491 -0.335864
C -4.121329 -0.403444 0.150615
C -5.056748 0.673605 -0.467149
C -6.488642 0.396635 -0.253064
C -7.685253 0.157470 -0.069486
H 1.966740 1.283729 1.482909
H 2.613406 -2.372984 0.740106
H 2.136264 -1.186286 2.014850
H 1.725358 0.004474 -2.165437
H 1.772192 -1.728936 -1.652916
H 3.808193 2.171019 -0.296935
H 3.554770 1.396636 -1.884131
H 5.171227 1.387308 -1.130641
H 4.499516 -1.012948 1.669971
H 5.592333 0.237296 1.027524
H 4.093563 0.720331 1.857213
H 4.067000 -1.163323 -2.114423
H 5.539307 -1.033848 -1.122796
H 4.263278 -2.187939 -0.660074
H -1.904226 -2.134879 0.087854
H -1.870539 -1.215229 1.614590
H -2.434431 -0.003567 -1.180720
H -2.389109 0.914849 0.338563
H -4.323127 -0.475106 1.237209
H -4.371121 -1.390403 -0.285307
H -4.857390 0.748946 -1.554898
H -4.807278 1.663512 -0.035416
H -8.727641 -0.048574 0.089067


