%chk=000240647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240647

0 1
O 3.954722 -1.578779 -0.000299
O -3.956616 -1.575959 0.000239
O 8.244594 0.962197 -0.000699
O -8.244698 0.968086 -0.000280
O 6.841670 2.712198 0.000063
O -6.840528 2.717090 -0.000170
N -0.000422 -0.069168 0.000210
N 2.326722 0.055484 0.000019
N -2.327476 0.057160 0.000430
C 1.172038 -0.783043 0.000058
C -1.173401 -0.782205 0.000256
C 1.212142 -2.189818 -0.000053
C -1.214518 -2.188943 0.000155
C -0.001436 -2.879485 0.000000
C 3.663326 -0.400092 -0.000159
C -3.664406 -0.397474 0.000519
C 4.669667 0.710803 -0.000181
C -4.669955 0.714137 0.000385
C 5.974511 0.427654 -0.000140
C -5.975003 0.431926 -0.000135
C 6.987046 1.512400 -0.000141
C -6.986761 1.517399 -0.000246
H 2.167585 -2.723486 -0.000176
H -2.170357 -2.721922 0.000204
H -0.001824 -3.972387 -0.000077
H 2.128825 1.065715 0.000137
H -2.128838 1.067253 0.000441
H 4.300858 1.742848 -0.000222
H -4.300418 1.745923 0.000752
H 6.368687 -0.600640 -0.000098
H -6.369920 -0.596084 -0.000489
H 8.965583 1.652310 -0.000822
H -8.965200 1.658706 -0.000283


%chk=000240647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240647

0 1
O 4.062742 -1.677321 0.000249
O -4.064747 -1.674424 0.000050
O 8.182753 1.274408 -0.000150
O -8.182638 1.280263 0.000691
O 6.517559 2.905162 -0.000461
O -6.516280 2.909827 0.000118
N -0.000492 -0.251209 -0.000255
N 2.306251 -0.109461 -0.000113
N -2.307132 -0.107821 -0.000441
C 1.170046 -0.950075 -0.000070
C -1.171526 -0.949244 -0.000232
C 1.228516 -2.368840 0.000148
C -1.231002 -2.367964 -0.000026
C -0.001489 -3.060900 0.000165
C 3.657171 -0.474908 0.000045
C -3.658314 -0.472302 -0.000458
C 4.582343 0.697855 -0.000078
C -4.582641 0.701126 -0.000276
C 5.932386 0.525811 0.000033
C -5.932809 0.530057 0.000101
C 6.845170 1.692920 -0.000065
C -6.844756 1.697820 0.000242
H 2.193887 -2.875061 0.000293
H -2.196731 -2.873500 -0.000026
H -0.001879 -4.155574 0.000326
H 2.065049 0.886912 -0.000282
H -2.065216 0.888379 -0.000560
H 4.173655 1.717890 -0.000250
H -4.173211 1.720864 -0.000464
H 6.368553 -0.478243 0.000209
H -6.369704 -0.473681 0.000291
H 8.778252 2.072378 -0.000391
H -8.777567 2.078658 0.000833


