%chk=000213163.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213163

0 1
O 2.236523 -0.126318 0.745936
O -0.100667 2.197352 -0.480678
O 2.913921 1.878946 1.642329
O -1.901522 2.434279 -1.895679
N 4.259606 0.651061 0.157129
N -1.344762 4.065200 -0.326236
C -0.086280 -0.175169 0.063854
C -1.544520 -0.039597 0.500207
C 0.171950 -1.590476 -0.452643
C 0.881416 0.079818 1.247196
C 0.189329 0.883031 -1.035362
C -1.914119 0.472412 1.750305
C 0.963354 -1.838205 -1.582119
C -2.550887 -0.425221 -0.404383
C -0.371998 -2.679204 0.251992
C -3.266204 0.586553 2.095245
C 1.189613 -3.150788 -2.011779
C -3.897335 -0.305564 -0.059327
C -0.141884 -3.986895 -0.177604
C -4.259959 0.198490 1.195068
C 0.637590 -4.227319 -1.314505
C 3.138123 0.914333 0.943471
C -1.218313 2.851437 -0.984909
C 5.518279 1.357953 0.482501
H 0.780356 1.110074 1.646323
H 0.776170 -0.672508 2.047343
H -0.410693 0.708280 -1.948443
H 1.267682 0.957599 -1.274681
H -1.166368 0.798257 2.470755
H 1.424280 -1.021246 -2.133840
H -2.279854 -0.814754 -1.386644
H -0.984377 -2.504515 1.137027
H -3.540299 0.982268 3.071821
H 1.801247 -3.330247 -2.894564
H -4.667050 -0.600320 -0.771582
H -0.571168 -4.821876 0.374050
H -5.310245 0.289821 1.463781
H 0.813358 -5.246767 -1.650983
H 4.357613 -0.281667 -0.244670
H -2.195683 4.594720 -0.440749
H -0.780028 4.267126 0.485224
H 5.301053 2.355237 0.914822
H 6.090105 1.513514 -0.448905
H 6.143946 0.804495 1.201606


%chk=000213163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213163

0 1
O 2.239702 0.232333 0.367496
O -0.384547 2.312142 -0.759802
O 3.164117 1.286063 2.269198
O -2.133433 2.488634 -2.345968
N 4.488666 0.506671 0.483395
N -1.713820 4.150503 -0.742417
C -0.139559 -0.052637 -0.083855
C -1.570911 0.007492 0.507352
C 0.176588 -1.489964 -0.571383
C 0.903785 0.350392 0.990635
C -0.044983 0.963081 -1.259222
C -1.856919 0.534785 1.791649
C 0.747472 -1.771816 -1.837478
C -2.654502 -0.461638 -0.281266
C -0.083455 -2.578278 0.303177
C -3.185156 0.581935 2.276996
C 1.046009 -3.100866 -2.219107
C -3.979648 -0.409533 0.195545
C 0.221333 -3.903437 -0.069483
C -4.252647 0.111929 1.482029
C 0.788235 -4.172803 -1.337300
C 3.305088 0.730933 1.148730
C -1.487906 2.948193 -1.372801
C 5.780362 0.922059 1.033716
H 0.759438 1.393981 1.317501
H 0.858537 -0.318651 1.868631
H -0.734015 0.705661 -2.082155
H 0.990661 1.032062 -1.628511
H -1.055241 0.914233 2.433034
H 0.968922 -0.965187 -2.542960
H -2.457223 -0.876796 -1.276421
H -0.543901 -2.385173 1.279575
H -3.381913 0.988439 3.275729
H 1.480932 -3.295901 -3.206201
H -4.798057 -0.773234 -0.435594
H 0.010862 -4.725510 0.623995
H -5.281586 0.150926 1.856892
H 1.020795 -5.201984 -1.633017
H 4.437074 0.014792 -0.408832
H -2.476295 4.736056 -1.069782
H -1.149753 4.426471 0.057476
H 5.592995 1.407521 2.004655
H 6.288277 1.645206 0.368723
H 6.446921 0.054516 1.195128


