%chk=000214820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214820

2 1
O -0.023205 2.844025 1.474352
O -0.206955 -1.713133 -1.449485
O 0.801691 -2.132946 1.480118
N -1.659072 1.210447 1.185142
N 1.820715 1.661337 0.538509
N -2.106524 -2.945237 -1.123196
N 2.651956 -3.093491 0.526467
C -0.820750 1.913169 2.221129
C 1.394692 2.746321 1.494978
C -1.305987 -0.037820 0.719206
C 1.936604 0.374465 1.020511
C -2.742839 1.881442 0.634590
C 1.967103 1.906577 -0.818125
C -1.981512 -0.593302 -0.371133
C 2.070120 -0.701779 0.141971
C -3.477593 1.297237 -0.393244
C 2.188581 0.849146 -1.697669
C -3.091234 0.057795 -0.925572
C 2.201318 -0.478195 -1.236762
C -1.351480 -1.813110 -1.023193
C 1.800263 -2.060607 0.765838
H -1.468951 2.562924 2.869604
H -0.240610 1.198137 2.838712
H 1.698785 3.764146 1.123542
H 1.804848 2.561634 2.513769
H -0.487486 -0.616778 1.222224
H 1.896871 0.204535 2.113569
H -2.996969 2.883827 1.030739
H 1.894377 2.952103 -1.172645
H -4.359062 1.827109 -0.798927
H 2.326256 1.060244 -2.774064
H -3.645137 -0.381989 -1.771342
H 2.273047 -1.321155 -1.945887
H -3.025828 -3.053354 -0.716228
H -1.716295 -3.780010 -1.562140
H 3.487614 -3.023385 -0.038148
H 2.471746 -4.008026 0.945490


%chk=000214820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214820

2 1
O -0.028933 2.833483 1.256126
O -0.337067 -1.847368 -1.181861
O 1.032454 -2.049848 1.666126
N -1.803791 1.220635 1.145630
N 1.983924 1.669191 0.517731
N -2.425136 -2.877023 -1.368793
N 2.771433 -3.126703 0.535606
C -0.884240 1.963819 2.070240
C 1.413253 2.756322 1.399302
C -1.430614 -0.001990 0.639095
C 2.035647 0.396268 1.023243
C -2.970377 1.843114 0.739155
C 2.292241 1.920155 -0.805760
C -2.220343 -0.640547 -0.335861
C 2.329301 -0.705614 0.204528
C -3.804690 1.221692 -0.196906
C 2.658096 0.859142 -1.645912
C -3.431520 -0.029350 -0.746626
C 2.660592 -0.470495 -1.152515
C -1.594549 -1.860786 -0.993304
C 2.016774 -2.041695 0.853361
H -1.496705 2.610162 2.718327
H -0.320881 1.236424 2.679804
H 1.791402 3.729927 1.056255
H 1.732643 2.559447 2.437890
H -0.515279 -0.479833 1.013388
H 1.800601 0.251672 2.080442
H -3.190371 2.821984 1.171106
H 2.222217 2.955151 -1.148311
H -4.726499 1.722672 -0.501678
H 2.906620 1.073343 -2.688121
H -4.066211 -0.495865 -1.507159
H 2.876268 -1.301220 -1.831158
H -3.411751 -2.921353 -1.111187
H -2.025593 -3.683999 -1.854302
H 3.607129 -3.078566 -0.048224
H 2.533052 -4.030044 0.953023


