%chk=000241614.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241614

0 1
S 0.677222 1.415440 0.768577
O 0.911932 2.717345 0.208591
O -0.021714 1.318399 2.017554
O -3.754568 -0.021559 -0.228174
O 0.282285 -1.343510 -1.877390
O -2.116765 -1.463412 0.378070
N -0.170169 0.447765 -0.434608
C -1.583676 0.679117 -0.785164
C 2.092898 0.418105 0.696904
C 1.942119 -0.603870 -0.265929
C -1.844970 0.718202 -2.303890
C 0.609928 -0.602898 -0.983512
C -2.442998 -0.425984 -0.137062
C 3.255328 0.526921 1.433369
C 2.952849 -1.521414 -0.496542
C -1.278677 1.980780 -2.939113
C 4.291531 -0.404233 1.204269
C 4.141774 -1.411088 0.255131
C -4.782632 -0.874339 0.371793
C -4.789542 -0.686387 1.873719
H -1.905155 1.663572 -0.335471
H -1.412129 -0.185013 -2.789804
H -2.941248 0.662844 -2.477839
H 3.386469 1.310605 2.182638
H 2.828762 -2.312121 -1.240751
H -1.758122 2.888057 -2.552006
H -0.200885 2.082464 -2.754840
H -1.422870 1.971583 -4.026283
H 5.214349 -0.328401 1.781271
H 4.947703 -2.128263 0.085324
H -5.689718 -0.482796 -0.123487
H -4.587816 -1.919677 0.073104
H -5.635357 -1.203576 2.340818
H -3.867952 -1.082090 2.328810
H -4.850287 0.374736 2.148920


%chk=000241614-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241614

0 1
S 0.762703 1.605586 0.708307
O 1.121271 3.026676 0.015674
O -0.030493 1.631447 2.121884
O -3.744643 -0.231555 -0.322699
O 0.152330 -1.513059 -1.719558
O -1.921522 -1.279013 0.691827
N -0.152751 0.497398 -0.539384
C -1.583582 0.720299 -0.760253
C 2.208301 0.401813 0.636540
C 1.917896 -0.646313 -0.252035
C -1.928627 0.889176 -2.269062
C 0.569915 -0.634281 -0.914908
C -2.391981 -0.391359 -0.047577
C 3.408198 0.536022 1.339754
C 2.892175 -1.645549 -0.451806
C -1.237807 2.122008 -2.883088
C 4.377401 -0.478440 1.129952
C 4.119243 -1.554247 0.244487
C -4.679958 -1.187410 0.358418
C -5.031838 -0.687445 1.761148
H -1.850343 1.668068 -0.247433
H -1.635442 -0.032162 -2.800934
H -3.026585 0.983265 -2.339748
H 3.595971 1.372075 2.019432
H 2.670497 -2.468535 -1.138683
H -1.567136 3.057111 -2.392727
H -0.139649 2.063221 -2.781561
H -1.477264 2.199489 -3.958543
H 5.333019 -0.425702 1.661232
H 4.881670 -2.326099 0.099014
H -5.554669 -1.208548 -0.310630
H -4.197126 -2.179589 0.390182
H -5.777643 -1.363813 2.218584
H -4.139239 -0.672314 2.408453
H -5.464395 0.327081 1.722739


