%chk=000280772.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280772

0 1
O -2.167580 -1.754477 -0.269037
O -3.150157 2.851297 -1.311132
O 6.587128 -0.282616 1.230905
O 4.890958 1.169714 1.406681
N 1.103929 1.077487 -1.948043
N -1.081904 1.974488 -1.528285
N 3.571182 -1.373125 2.295311
N -0.588332 -0.329169 -1.011538
C 2.671927 -0.097998 -0.373655
C 3.711535 -1.216163 -0.266934
C 2.105698 -0.013370 -1.798586
C 4.433665 -1.255334 1.096608
C -4.346718 0.294164 -0.468159
C -4.593049 -0.250951 0.946865
C -2.893195 0.512396 -0.763148
C -6.088035 -0.458010 1.218136
C -0.197394 0.886410 -1.461247
C -2.505460 1.831863 -1.185495
C -1.931717 -0.484688 -0.687339
C 5.249810 0.024319 1.276486
C -6.335181 -1.030035 2.611568
H 1.837697 -0.284454 0.336397
H 3.117799 0.873084 -0.069091
H 3.222337 -2.197853 -0.438786
H 4.466624 -1.118918 -1.073714
H 2.909668 0.187607 -2.542164
H 1.628380 -0.984021 -2.083034
H 5.143998 -2.134237 1.104701
H -4.782179 -0.386229 -1.229243
H -4.896484 1.256486 -0.592637
H -4.163449 0.445760 1.694125
H -4.048900 -1.213811 1.088956
H 1.490906 2.020490 -1.877103
H -6.623388 0.507322 1.110758
H -6.525552 -1.129780 0.453816
H -0.782804 2.889954 -1.877069
H 2.912746 -0.598263 2.358821
H 3.030698 -2.233870 2.264959
H -7.407389 -1.158198 2.801246
H -5.943586 -0.369818 3.394614
H -5.861292 -2.009223 2.741120
H -3.118546 -1.848024 0.089846
H 7.173806 0.509795 1.365921


%chk=000280772-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280772

0 1
O -1.956741 -1.962560 -0.528451
O -3.369994 2.629537 -1.340412
O 6.226555 0.009209 1.115679
O 4.525446 0.458196 2.630422
N 1.105548 1.258428 -1.884582
N -1.163547 1.902448 -1.593410
N 3.240276 -1.910304 1.958932
N -0.466088 -0.341736 -1.188446
C 2.785521 0.077855 -0.415804
C 3.826812 -1.059293 -0.385588
C 2.200688 0.269843 -1.833446
C 4.299660 -1.450124 1.063413
C -4.262570 -0.074904 -0.526057
C -4.514814 -0.126373 1.008685
C -2.840184 0.288753 -0.898050
C -5.967956 -0.519815 1.356706
C -0.185237 0.919276 -1.543745
C -2.549378 1.660509 -1.270425
C -1.774307 -0.623718 -0.881481
C 4.985870 -0.251942 1.709195
C -6.230604 -0.552630 2.877547
H 1.952468 -0.169933 0.267651
H 3.235398 1.026344 -0.060701
H 3.384766 -1.973055 -0.832186
H 4.717567 -0.798612 -0.990056
H 2.984529 0.596700 -2.542616
H 1.792730 -0.692385 -2.189160
H 5.075551 -2.232579 0.940323
H -4.565670 -1.042346 -0.986227
H -4.927075 0.692829 -0.962688
H -4.290649 0.871519 1.432317
H -3.812381 -0.834635 1.497043
H 1.332984 2.235247 -2.066629
H -6.660478 0.199808 0.875452
H -6.197781 -1.513337 0.918079
H -0.955635 2.864595 -1.877822
H 2.860977 -1.195955 2.584734
H 2.548759 -2.536782 1.545473
H -7.277542 -0.828256 3.101241
H -6.036856 0.436604 3.332718
H -5.572901 -1.286991 3.380135
H -2.911147 -2.125480 -0.315583
H 6.635629 0.806047 1.550220


