%chk=000285199.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285199

0 1
S 1.169313 -2.237767 0.139557
O 1.578271 -2.523746 -1.208795
O 1.197760 -3.296874 1.135386
O 1.848739 0.597194 -0.573646
O -4.061803 1.825384 -1.440646
N 3.636913 0.883337 0.857710
N 2.341770 -1.134672 0.835270
N -4.125701 0.410222 0.384294
C 4.007032 2.213514 0.282283
C -0.334253 -1.437038 0.195659
C 5.214765 2.063843 -0.648015
C 4.297694 3.177488 1.435933
C 2.582652 0.152196 0.301545
C -0.679595 -0.477213 -0.767572
C -1.250984 -1.763904 1.207570
C -2.837706 -0.184333 0.283168
C -1.923692 0.148972 -0.731133
C -2.495463 -1.150959 1.263316
C -4.674336 1.391825 -0.491776
C -6.064003 1.815614 -0.112718
H 3.123110 2.584692 -0.310638
H 4.299682 0.458031 1.494767
H 2.913738 -1.474217 1.617754
H 5.481556 3.025079 -1.102192
H 6.103275 1.690549 -0.129185
H 4.997780 1.368465 -1.470349
H 3.442762 3.251035 2.120190
H 4.498567 4.186217 1.055564
H 5.168173 2.875496 2.027781
H 0.039693 -0.204503 -1.556546
H -0.984330 -2.517788 1.960482
H -2.179153 0.899630 -1.488957
H -3.193733 -1.417386 2.051661
H -4.703540 0.088688 1.165839
H -6.783495 0.985861 -0.142338
H -6.429175 2.575618 -0.826642
H -6.111486 2.272955 0.884920


%chk=000285199-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285199

0 1
S 1.204354 -2.119250 0.180721
O 1.665045 -2.421423 -1.337679
O 1.208640 -3.294622 1.309254
O 2.025729 0.766903 -0.621037
O -4.422695 1.757126 -1.585482
N 3.813376 0.929755 0.885567
N 2.351546 -0.910560 0.976078
N -4.337506 0.360014 0.302110
C 4.284299 2.240458 0.374126
C -0.477031 -1.286817 0.199359
C 5.340342 2.053739 -0.740625
C 4.812212 3.092969 1.545481
C 2.707350 0.297625 0.339751
C -0.824869 -0.400716 -0.831622
C -1.343593 -1.646102 1.245168
C -3.023588 -0.170186 0.225129
C -2.115891 0.164864 -0.819824
C -2.628842 -1.076570 1.250701
C -4.974663 1.265209 -0.562101
C -6.406118 1.600751 -0.145999
H 3.393296 2.722233 -0.066834
H 4.388343 0.456476 1.584819
H 2.882648 -1.355859 1.733692
H 5.641248 3.033744 -1.154361
H 6.246455 1.553234 -0.349695
H 4.926609 1.443238 -1.561194
H 4.033490 3.238721 2.314711
H 5.129368 4.085391 1.179766
H 5.692858 2.618817 2.022164
H -0.102047 -0.144611 -1.610119
H -1.024134 -2.359536 2.010945
H -2.428193 0.861908 -1.598328
H -3.330507 -1.340245 2.051641
H -4.894932 0.035584 1.096511
H -7.044304 0.697647 -0.139106
H -6.820329 2.319285 -0.867162
H -6.437171 2.052311 0.862977


