%chk=000277475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277475

0 1
O 2.013544 -3.187117 -0.000295
O 3.341762 -1.491184 -0.000583
N -0.014611 2.507510 0.000070
N -2.600810 -1.618107 -0.000005
N 2.227044 -1.985326 -0.000193
C -1.339745 0.484623 0.000092
C 1.160554 0.350679 -0.000044
C -0.033842 1.128472 0.000039
C -1.403698 -0.929173 0.000010
C 1.032577 -1.094130 -0.000101
C -0.186399 -1.711273 -0.000062
C 2.393749 1.057157 -0.000073
C -2.564451 1.208011 0.000207
C 2.403992 2.437272 -0.000056
C -3.758142 0.516494 0.000193
C 1.167943 3.136031 0.000015
C -3.735054 -0.908146 0.000073
H -0.284578 -2.810255 -0.000084
H 3.343314 0.503058 -0.000081
H -2.535761 2.303432 0.000310
H 3.341343 2.992291 -0.000100
H -4.713991 1.038707 0.000271
H 1.141802 4.233842 0.000051
H -4.673143 -1.480170 0.000047


%chk=000277475-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277475

0 1
O 1.969542 -3.302774 0.002816
O 3.408928 -1.549728 -0.003962
N -0.031748 2.516810 0.000142
N -2.610792 -1.642615 0.000060
N 2.209832 -2.034653 -0.000541
C -1.335137 0.487366 -0.000008
C 1.188666 0.353227 -0.000188
C -0.030384 1.137130 -0.000014
C -1.411170 -0.945663 0.000026
C 1.040094 -1.097159 -0.000179
C -0.201166 -1.715837 -0.000048
C 2.422808 1.081566 0.000045
C -2.556495 1.222386 -0.000002
C 2.401423 2.481728 0.000304
C -3.767053 0.519079 0.000055
C 1.153431 3.162065 0.000251
C -3.745591 -0.910500 0.000081
H -0.275200 -2.805979 0.000005
H 3.365708 0.536888 -0.000138
H -2.506910 2.314182 -0.000028
H 3.335506 3.051109 0.000472
H -4.726764 1.044701 0.000074
H 1.109538 4.257099 0.000342
H -4.683666 -1.477731 0.000134


