%chk=000282727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282727

0 1
O 3.027791 1.425258 -0.863706
O 2.443938 -2.365140 -0.994964
O -0.254475 -0.498561 1.348194
O 4.298577 -1.955753 0.184349
N -1.228958 0.031881 -0.674766
C 1.572781 1.519441 -0.759522
C 3.282189 0.853568 0.461106
C 1.215655 0.015452 -0.500560
C 2.394976 -0.437345 0.411227
C 1.395441 2.352520 0.534658
C 2.600142 1.884628 1.392726
C -0.131098 -0.189210 0.179029
C 3.177535 -1.611411 -0.105530
C -2.614233 -0.077021 -0.315640
C -3.561743 0.191206 -1.326534
C -3.033665 -0.428323 0.977854
C -4.921585 0.105358 -1.027565
C -4.400126 -0.507839 1.253204
C -5.346713 -0.242575 0.258999
H 1.197788 1.950066 -1.690886
H 4.362127 0.701551 0.561725
H 1.251460 -0.548066 -1.466004
H 2.013705 -0.709894 1.434947
H 0.432900 2.177661 1.038991
H 1.451983 3.431050 0.316147
H 3.282777 2.718990 1.620903
H 2.285049 1.453498 2.355174
H -1.049373 0.265633 -1.653710
H 2.947007 -3.160125 -1.323214
H -3.247315 0.461167 -2.330826
H -2.301045 -0.641452 1.763233
H -5.656927 0.311274 -1.805219
H -4.727603 -0.781223 2.256799
H -6.408561 -0.307466 0.483980


%chk=000282727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282727

0 1
O 3.085831 1.554516 -0.872190
O 2.024590 -2.359222 -1.045248
O -0.277597 0.001433 1.508414
O 4.152953 -1.995527 -0.199905
N -1.265393 -0.025624 -0.623594
C 1.637013 1.756109 -0.574139
C 3.378619 0.808954 0.394756
C 1.162730 0.256131 -0.462894
C 2.364145 -0.377545 0.316814
C 1.659111 2.466446 0.805513
C 2.914768 1.808175 1.485925
C -0.180013 0.053136 0.242796
C 2.968449 -1.614365 -0.318296
C -2.652013 -0.159827 -0.318749
C -3.553955 -0.223981 -1.415521
C -3.150889 -0.230117 1.009414
C -4.938546 -0.356254 -1.190716
C -4.541334 -0.362102 1.216603
C -5.442428 -0.425845 0.129438
H 1.178453 2.317794 -1.400071
H 4.433568 0.508053 0.403094
H 1.127697 -0.155030 -1.486154
H 2.021566 -0.665076 1.331510
H 0.736251 2.302883 1.384248
H 1.802621 3.550179 0.663957
H 3.703271 2.553811 1.679096
H 2.663340 1.305834 2.435168
H -1.037841 -0.013409 -1.621082
H 2.461604 -3.184387 -1.391181
H -3.171324 -0.170731 -2.443449
H -2.453760 -0.185522 1.847592
H -5.622221 -0.404843 -2.045284
H -4.920534 -0.416633 2.243210
H -6.518333 -0.528616 0.305524


