%chk=000010524.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010524

0 1
 O    4.315800      0.8945000      0.5876000    
 N   -2.461300      -1.725200      0.7808000    
 C  -0.6565000      0.7641000      0.3128000    
 C   -1.536200      8.6999997E-02 -0.7411000    
 C   -1.492300      -1.384500     -0.2447000    
 C   -1.264400      0.3984000       1.748200    
 C  -0.6161000       2.294800      8.6700000E-02
 C   -2.887600      0.7512000      -1.036500    
 C   0.7733000      0.1105000      5.4099999E-02
 C  -0.3318000      -2.046700     -0.9957000    
 C   -2.518000     -0.5990000       1.763400    
 C   -1.989300       2.920900     -0.1564000    
 C   -2.712400       2.241300      -1.312700    
 C   0.9139000      -1.167400     -0.6353000    
 C    1.936600      0.7700000      0.4713000    
 C   -3.741900      -2.195100      0.3005000    
 C    2.185400      -1.675300     -0.9183000    
 C    3.194400      0.2322000      0.1853000    
 C    3.318000     -0.9719000     -0.5120000    
 C    5.570300      0.3003000      0.2621000    
 H   -1.028900      0.1618000      -1.719000    
 H   -2.143100      -1.762000      -1.055200    
 H   -1.561600       1.308600       2.282200    
 H  -0.4731000     -6.4199999E-02   2.352700    
 H   1.2000000E-02   2.523200     -0.7856000    
 H  -0.1472000       2.795500      0.9426000    
 H   -3.610100      0.6574000     -0.2282000    
 H   -3.345100      0.2734000      -1.911400    
 H  -0.4445000      -2.071100      -2.087400    
 H  -0.1719000      -3.063200     -0.6194000    
 H   -2.586900      -1.032900       2.768400    
 H   -3.430400     -6.8999999E-03   1.640400    
 H   -1.867000       3.987000     -0.3794000    
 H   -2.599300       2.855900      0.7521000    
 H   -3.693400       2.706700      -1.461200    
 H   -2.146600       2.384300      -2.241400    
 H    1.879100       1.709100       1.014300    
 H   -4.381800      -2.459200       1.150500    
 H   -3.631300      -3.115000     -0.2862000    
 H   -4.289200      -1.465400     -0.3022000    
 H    2.298000      -2.625800      -1.432500    
 H    4.270000      -1.429100     -0.7603000    
 H    5.720800      0.2425000     -0.8213000    
 H    5.696500     -0.6709000      0.7528000    
 H    6.351200      0.9590000      0.6564000    


%chk=000010524-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010524

0 1
O 4.126006 0.698804 0.858837
N -2.006318 -1.622465 0.639217
C -0.746951 0.865547 0.064100
C -1.755340 0.312195 -0.985527
C -1.862138 -1.221514 -0.790225
C -1.289608 0.604499 1.522137
C -0.557086 2.398581 -0.174277
C -3.096568 1.083443 -1.031660
C 0.598200 0.113710 -0.118115
C -0.562779 -1.841495 -1.355609
C -2.305365 -0.562339 1.615305
C -1.888346 3.184123 -0.267257
C -2.843482 2.580736 -1.322133
C 0.672102 -1.151911 -0.781349
C 1.784973 0.671554 0.410036
C -2.787877 -2.849619 0.831303
C 1.928180 -1.789742 -0.893996
C 3.031806 0.018933 0.285558
C 3.115793 -1.227729 -0.377519
C 5.438898 0.064269 0.748852
H -1.294311 0.460288 -1.987303
H -2.732919 -1.591864 -1.383445
H -1.775686 1.518188 1.914844
H -0.423897 0.393703 2.174546
H 0.010449 2.538069 -1.116880
H 0.060984 2.834823 0.634276
H -3.654568 0.984198 -0.081933
H -3.737120 0.641322 -1.821520
H -0.570601 -1.759785 -2.463752
H -0.524969 -2.921881 -1.117063
H -2.248002 -1.013271 2.625691
H -3.352049 -0.172478 1.516820
H -1.667831 4.242296 -0.508556
H -2.396759 3.188833 0.718296
H -3.799378 3.139230 -1.339774
H -2.389260 2.685309 -2.329722
H 1.774947 1.632376 0.933692
H -2.667556 -3.215900 1.867983
H -2.424307 -3.642225 0.151882
H -3.884360 -2.716522 0.640037
H 1.980199 -2.765164 -1.394844
H 4.065866 -1.759037 -0.486849
H 5.738433 -0.066903 -0.309954
H 5.458629 -0.918594 1.260215
H 6.136066 0.754209 1.247435


