%chk=000194714.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194714

0 1
O -3.180563 2.620125 1.544861
O -1.699258 0.986282 1.187267
O 0.596983 0.157789 -3.380705
O 3.331215 -2.815645 1.361413
O -0.267274 1.875303 -2.395902
O 2.091668 -3.649225 -0.197325
O 1.365912 2.986090 1.968023
O 2.410009 1.513915 3.165268
N 0.357812 -2.153275 -1.438679
N -5.168823 0.796021 1.091313
N 0.321194 0.806715 -2.382313
N 2.474924 -2.712304 0.505875
N 1.820498 1.870713 2.160578
C -2.459603 -0.619211 -1.229669
C -2.124827 -2.044544 -1.677833
C -3.685572 -0.580140 -0.312156
C -0.773766 -2.141497 -2.403233
C -3.981841 0.848190 0.189831
C 0.965425 -1.121867 -0.820120
C 0.746388 0.286782 -1.083823
C 1.862503 -1.405092 0.299019
C -2.818585 1.407862 1.012526
C 0.983161 1.239494 -0.091932
C 2.140951 -0.422464 1.251330
C 1.642123 0.878391 1.095391
H -1.597794 -0.192055 -0.670916
H -2.616015 0.032184 -2.111532
H -2.917067 -2.420977 -2.358484
H -2.139555 -2.730294 -0.804840
H -4.576810 -0.976164 -0.836933
H -3.533517 -1.247935 0.564059
H -0.719102 -3.101883 -2.973464
H -0.667121 -1.349061 -3.181805
H -4.113721 1.539741 -0.689410
H 0.663779 -3.126261 -1.183956
H -5.995197 0.499334 0.580696
H -5.361137 1.715424 1.490170
H 0.680468 2.292590 -0.248457
H 2.758429 -0.668402 2.137675
H -2.460291 3.034753 2.098489


%chk=000194714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194714

0 1
O -3.494377 2.231709 2.129426
O -1.849140 0.727749 1.511540
O 0.684105 0.147695 -3.512472
O 2.805021 -2.868074 1.847529
O -0.308925 1.936452 -2.499225
O 1.657033 -3.717393 0.081574
O 1.982860 3.302838 1.548863
O 2.923055 1.742961 2.931792
N 0.375416 -2.095561 -1.508678
N -5.373642 0.791898 0.854982
N 0.359432 0.831609 -2.460837
N 2.091219 -2.700368 0.792225
N 2.291761 2.085970 1.858514
C -2.428249 -0.642232 -1.192397
C -2.131315 -2.036304 -1.783924
C -3.710653 -0.613307 -0.333273
C -0.743924 -2.148125 -2.478118
C -4.021752 0.778910 0.270627
C 0.959189 -1.064299 -0.840751
C 0.838893 0.352204 -1.153536
C 1.750426 -1.334192 0.365925
C -3.001113 1.186318 1.340969
C 1.234141 1.361747 -0.272335
C 2.188257 -0.314622 1.225972
C 1.888651 1.020713 0.925943
H -1.596090 -0.325268 -0.542492
H -2.508328 0.100785 -2.012258
H -2.895727 -2.299163 -2.542830
H -2.196355 -2.804361 -0.987403
H -4.583697 -0.910414 -0.949930
H -3.640015 -1.346298 0.491768
H -0.662329 -3.134951 -2.967488
H -0.628372 -1.384739 -3.262533
H -3.879458 1.540131 -0.543874
H 0.676423 -3.014268 -1.119461
H -6.112439 0.568504 0.182972
H -5.577754 1.614249 1.429624
H 1.061523 2.410594 -0.528588
H 2.740352 -0.570998 2.133975
H -2.808100 2.501303 2.798481


