%chk=000214627.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214627

0 1
O 0.153551 0.682154 0.000073
O -1.341108 -3.161233 -0.000432
N 3.456501 -0.858544 0.000298
N 2.837829 1.334632 0.000088
N 4.519142 -0.020077 0.000093
N 4.126590 1.298461 0.000250
C -1.228316 0.457289 -0.000144
C -1.787539 -0.823473 -0.000371
C -2.005681 1.641807 -0.000053
C -0.916047 -2.025772 -0.000471
C 0.972374 -0.436821 -0.000172
C -3.192318 -0.936659 -0.000501
C -3.391317 1.485356 -0.000190
C 0.525286 -1.705824 -0.000433
C -3.980614 0.206959 -0.000413
C -1.341914 2.973617 0.000098
C 2.373566 -0.016780 -0.000033
H -3.636494 -1.936518 -0.000662
H -4.033049 2.368021 -0.000138
H 1.205170 -2.562786 -0.000647
H -5.066889 0.121313 -0.000519
H -2.053294 3.807916 0.001916
H -0.687481 3.091600 0.879693
H -0.690223 3.093104 -0.881318
H 5.484874 -0.349340 0.000188


%chk=000214627-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214627

0 1
O 0.164334 0.711284 -0.000008
O -1.328845 -3.205723 -0.000713
N 3.441401 -0.927466 -0.000104
N 2.884925 1.312396 -0.000155
N 4.531197 -0.106468 0.000421
N 4.234087 1.261023 -0.000191
C -1.233202 0.495339 -0.000126
C -1.779960 -0.815218 -0.000351
C -2.028710 1.671564 -0.000007
C -0.886952 -2.007778 -0.000452
C 1.008091 -0.397465 -0.000155
C -3.192323 -0.956811 -0.000480
C -3.427331 1.482337 -0.000122
C 0.547722 -1.694753 -0.000398
C -4.010025 0.184518 -0.000368
C -1.386552 3.043056 0.000128
C 2.419551 -0.015242 -0.000046
H -3.601953 -1.971953 -0.000656
H -4.074814 2.367051 -0.000016
H 1.264180 -2.520073 -0.000538
H -5.100150 0.081677 -0.000453
H -2.155865 3.833411 0.001658
H -0.736211 3.180629 0.882950
H -0.738607 3.181848 -0.884291
H 5.488609 -0.458782 0.000674


