%chk=000189840.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189840

0 1
S 4.931239 -3.461026 -1.571000
O 0.087437 1.029239 0.118981
O 1.761397 2.666245 1.524735
N 3.782778 0.181486 -0.248402
C 2.230375 1.961999 0.373288
C 2.837575 0.612199 0.821360
C 1.089628 1.774292 -0.640424
C -1.109414 0.741049 -0.497966
C -2.007589 0.016882 0.369232
C 3.903437 -1.308942 -0.335634
C -3.279410 -0.336933 -0.149846
C -1.448557 1.083370 -1.787852
C -1.659915 -0.346726 1.703718
C -3.623565 0.026550 -1.492361
C 4.828734 -1.641352 -1.505308
C -4.188015 -1.053580 0.691186
C -2.732339 0.712130 -2.277979
C -2.552353 -1.035512 2.489211
C -3.831358 -1.391376 1.974216
H 3.007553 2.648429 -0.040056
H 2.021667 -0.132652 0.959254
H 3.314583 0.741878 1.816291
H 1.407020 1.168594 -1.508176
H 0.652564 2.736139 -0.955866
H 4.706131 0.594628 -0.072622
H 2.884693 -1.727158 -0.519140
H 4.274749 -1.768748 0.607843
H -0.775714 1.622529 -2.444174
H -0.674236 -0.065709 2.076040
H -4.603340 -0.253611 -1.871613
H 5.836131 -1.207987 -1.370527
H 4.423073 -1.234553 -2.451928
H 0.921972 2.268857 1.854553
H -5.164229 -1.324060 0.292586
H -2.990155 0.989072 -3.300733
H -2.298525 -1.318104 3.508657
H -4.520797 -1.937082 2.617898
H 5.629677 -3.595058 -2.717843


%chk=000189840-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189840

0 1
S 5.194776 -3.513749 -1.497708
O 0.099031 1.066384 0.257320
O 1.797143 2.695615 1.716065
N 3.717202 0.172901 -0.329093
C 2.280259 2.023126 0.503237
C 3.001354 0.698857 0.855619
C 1.133745 1.809530 -0.493210
C -1.090736 0.724993 -0.405660
C -2.052903 0.007236 0.395812
C 4.116519 -1.251129 -0.261931
C -3.307686 -0.374780 -0.216684
C -1.355478 1.040079 -1.743389
C -1.805015 -0.335703 1.763797
C -3.559225 -0.039400 -1.589719
C 4.588200 -1.716139 -1.649352
C -4.269793 -1.084772 0.575551
C -2.600171 0.650468 -2.329810
C -2.764388 -1.028404 2.508028
C -4.007699 -1.405239 1.909615
H 3.005803 2.728975 0.056227
H 2.247018 -0.049104 1.164062
H 3.658455 0.893355 1.733268
H 1.488897 1.211603 -1.353742
H 0.715630 2.778450 -0.828214
H 4.517241 0.771822 -0.579664
H 3.231791 -1.841668 0.039240
H 4.916413 -1.451795 0.491627
H -0.625088 1.580334 -2.351352
H -0.849924 -0.050667 2.214076
H -4.511614 -0.333079 -2.044861
H 5.425826 -1.094466 -2.011396
H 3.755226 -1.668411 -2.367828
H 0.946270 2.252611 1.973822
H -5.220849 -1.373595 0.112445
H -2.791100 0.905597 -3.377869
H -2.566052 -1.287069 3.553922
H -4.752330 -1.947771 2.502533
H 5.366153 -3.729600 -2.855187


