%chk=000150031.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150031

0 1
 O    7.072100      3.8699999E-02  0.2071000    
 O    5.681300      -1.671500     -0.4023000    
 N   0.4753000       2.368700      0.5650000    
 N  -0.6300000     -0.1119000     -0.1996000    
 N    2.970200     -0.8851000     -0.3077000    
 N    4.859400      0.4370000      0.2090000    
 N    1.069000      -2.204800     -0.8114000    
 C   -1.416000      0.9149000     -6.4700000E-02
 C  -0.8983000       2.335400      0.1106000    
 C   -2.894400      0.7045000     -0.1270000    
 C    1.307800       1.304300      0.2693000    
 C   0.7557000      8.3200000E-02 -0.1247000    
 C   -4.836000     -0.7038000      0.2799000    
 C   -3.448800     -0.4910000      0.3312000    
 C   -5.672900      0.3105000     -0.2431000    
 C   -3.717600       1.701800     -0.6415000    
 C    2.693500       1.410600      0.3935000    
 C    1.624500     -0.9664000     -0.4000000    
 C   -5.097900       1.507600     -0.6997000    
 C    3.470700      0.3033000      9.1300003E-02
 C   -5.411000      -1.900900      0.7369000    
 C   -7.060300      9.7499996E-02 -0.2944000    
 C   -6.791300      -2.095400      0.6784000    
 C   -7.614200      -1.098300      0.1635000    
 C    5.842700     -0.5146000     -3.3300001E-02
 C    8.199400     -0.8208000      2.3000001E-03
 C    9.467200     -5.3399999E-02  0.3115000    
 H  -0.9592000       2.842100     -0.8592000    
 H   -1.525500       2.876100      0.8265000    
 H   0.8854000       3.258200      0.8233000    
 H   -2.805400      -1.268000      0.7406000    
 H   -3.314000       2.638000      -1.016100    
 H    3.145000       2.346100      0.7126000    
 H   -5.722200       2.299700      -1.108100    
 H   -4.787100      -2.694300       1.143200    
 H   -7.722700      0.8632000     -0.6927000    
 H   -7.223300      -3.025900       1.035000    
 H   -8.688700      -1.250500      0.1182000    
 H    5.196500       1.347900      0.5115000    
 H   0.1337000      -2.436900     -0.5002000    
 H    1.716300      -2.960200     -0.9998000    
 H    8.121300      -1.689200      0.6658000    
 H    8.216000      -1.158400      -1.040000    
 H    10.35030     -0.6817000      0.1650000    
 H    9.550200      0.8289000     -0.3317000    
 H    9.457000      0.3069000       1.345500    


%chk=000150031-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150031

0 1
O 7.133931 0.022785 0.218720
O 5.784283 -1.854704 -0.245272
N 0.510792 2.457973 0.157035
N -0.644376 -0.089630 -0.152737
N 2.967908 -0.977115 -0.187039
N 4.915605 0.351684 0.120568
N 1.057127 -2.298411 -0.463155
C -1.452307 0.958791 -0.129448
C -0.918293 2.403062 -0.202992
C -2.916869 0.758257 -0.090245
C 1.354836 1.366146 0.034209
C 0.743870 0.086620 -0.157230
C -4.866115 -0.748717 0.164255
C -3.458271 -0.524168 0.126814
C -5.769524 0.370986 -0.027476
C -3.826669 1.861871 -0.279710
C 2.763269 1.455286 0.132230
C 1.603742 -1.054718 -0.269204
C -5.206587 1.669920 -0.251091
C 3.508821 0.248221 0.014873
C -5.422375 -2.054427 0.392189
C -7.183752 0.143400 0.013676
C -6.804463 -2.245917 0.427462
C -7.693763 -1.138195 0.236400
C 5.891823 -0.638258 0.000332
C 8.331411 -0.854013 0.126142
C 9.541840 0.019066 0.444146
H -1.096011 2.802729 -1.230327
H -1.486893 3.047086 0.494794
H 0.917170 3.372595 0.349686
H -2.766089 -1.359774 0.274930
H -3.437878 2.868541 -0.465115
H 3.262196 2.419120 0.282777
H -5.882411 2.520098 -0.403183
H -4.740952 -2.900797 0.539163
H -7.862686 0.992289 -0.132245
H -7.217845 -3.245400 0.601681
H -8.776401 -1.303395 0.266337
H 5.293865 1.281195 0.313339
H 0.043474 -2.383299 -0.506426
H 1.676468 -3.102774 -0.520925
H 8.214906 -1.688490 0.841534
H 8.377808 -1.281130 -0.892553
H 10.465204 -0.585555 0.384445
H 9.626444 0.853317 -0.273470
H 9.467434 0.439947 1.461604


