%chk=000212267.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212267

0 1
O -1.425092 1.082604 1.303751
O -0.321643 -1.874117 -1.401738
N 0.349555 -0.850153 0.546406
N -0.138977 1.814177 -1.512459
N 1.373860 2.514651 0.033582
N 1.131059 1.806534 -1.989251
N 2.029557 2.236425 -1.045716
C -2.008174 -0.751749 -0.164356
C -2.391169 0.376527 0.575134
C -0.603940 -1.208876 -0.417325
C -3.028739 -1.508420 -0.772570
C -3.730647 0.767860 0.707477
C 1.744328 -1.178485 0.498629
C -4.368057 -1.142286 -0.640955
C -4.719042 -0.004160 0.096910
C -1.077954 2.395748 0.793895
C 2.261422 -2.152005 -0.372092
C 2.598110 -0.488194 1.385626
C -0.003216 2.252980 -0.225532
C 3.628637 -2.434867 -0.345266
C 3.959745 -0.786785 1.394123
C 4.480677 -1.759875 0.533167
H -2.747886 -2.387308 -1.365100
H -3.985623 1.646187 1.296125
H 0.057527 -0.237433 1.326341
H -5.143280 -1.741187 -1.118038
H -5.767883 0.279043 0.195751
H -0.707610 2.904745 1.712137
H -1.969755 2.911270 0.389949
H 1.601987 -2.681571 -1.066299
H 2.208167 0.281248 2.048994
H 4.030540 -3.191794 -1.018480
H 4.622551 -0.252913 2.074740
H 5.543534 -1.986599 0.546905
H 1.367832 1.478378 -2.926064


%chk=000212267-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212267

0 1
O -1.152351 1.003551 -0.134360
O -0.680511 -3.224883 -0.163476
N 0.412565 -1.169039 0.127426
N 0.198471 4.167177 -1.040972
N 1.162262 2.685268 0.428280
N 1.533207 4.394403 -0.853247
N 2.156073 3.514390 0.021370
C -2.058544 -1.242646 -0.026230
C -2.292702 0.165802 -0.039460
C -0.716908 -1.957163 -0.039523
C -3.195272 -2.089987 0.016981
C -3.604487 0.691726 0.016540
C 1.769360 -1.588994 0.215168
C -4.507631 -1.580771 0.063822
C -4.710562 -0.183647 0.070595
C -1.345599 2.455092 -0.040451
C 2.189728 -2.937944 0.053163
C 2.734783 -0.576817 0.481690
C -0.004384 3.092333 -0.219292
C 3.563108 -3.250152 0.154176
C 4.100375 -0.908437 0.577520
C 4.526112 -2.248235 0.413112
H -2.996045 -3.166644 0.012836
H -3.779973 1.771217 0.014647
H 0.244948 -0.155029 0.187247
H -5.361149 -2.264814 0.099700
H -5.723307 0.231438 0.113894
H -1.779833 2.705080 0.948297
H -2.020627 2.819821 -0.836621
H 1.443937 -3.709878 -0.141826
H 2.407351 0.460396 0.623291
H 3.880015 -4.291880 0.027908
H 4.831447 -0.118911 0.785297
H 5.588346 -2.505300 0.488678
H 2.038197 5.143076 -1.327777


