%chk=000093679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093679

0 1
 O   -2.325400       1.408100     -0.4270000    
 O    2.388000       1.332200     -0.4243000    
 O   -1.311500       1.325500       1.639500    
 O    1.369700       1.283000       1.641000    
 N   -1.296800      -3.095900      0.2703000    
 C   2.9400000E-02   1.253500     -0.4014000    
 C   1.0900000E-02  4.2599998E-02  -1.354600    
 C  -1.0400000E-02  -1.301600     -0.6631000    
 C   -1.252500       1.330900      0.4174000    
 C    1.312200       1.290400      0.4188000    
 C    1.171000      -1.935800     -0.3450000    
 C   -1.207100      -1.896900     -0.3479000    
 C   -3.605800       1.488000      0.2073000    
 C    3.669600       1.369700      0.2115000    
 C    1.119600      -3.170900      0.2915000    
 C  -0.1280000      -3.703300      0.5747000    
 C   -4.679400       1.567000     -0.8571000    
 C    4.746400       1.413300     -0.8516000    
 H   4.4300001E-02   2.178100     -0.9965000    
 H   0.8796000      7.7100001E-02  -2.025900    
 H  -0.8557000      0.1043000      -2.026600    
 H    2.135000      -1.498500     -0.5850000    
 H   -2.161200      -1.438700     -0.5848000    
 H   -3.645000       2.381900      0.8396000    
 H   -3.762800      0.5972000      0.8257000    
 H    3.796300      0.4742000      0.8301000    
 H    3.737500       2.261800      0.8441000    
 H    2.027400      -3.700900      0.5562000    
 H  -0.2223000      -4.664200       1.069800    
 H   -4.640400      0.6879000      -1.508900    
 H   -4.525300       2.443200      -1.495600    
 H   -5.673700       1.628800     -0.4061000    
 H    4.622100       2.294100      -1.490200    
 H    4.679200      0.5360000      -1.503500    
 H    5.741700       1.442200     -0.3995000    


%chk=000093679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093679

0 1
O -1.612182 1.216804 -0.825397
O 2.424976 1.707378 -0.621705
O -0.145828 1.073204 0.982167
O 2.746068 -0.596245 -0.566461
N -2.349812 -2.957425 0.488799
C 0.569440 0.361970 -1.295495
C 0.115786 -1.066366 -1.755839
C -0.395924 -1.973551 -0.646166
C -0.385565 0.926436 -0.234408
C 2.012133 0.395139 -0.783732
C 0.468702 -2.650151 0.252601
C -1.791814 -2.173319 -0.480047
C -2.696346 1.672516 0.106339
C 3.790494 1.909494 -0.037954
C -0.088142 -3.470701 1.257539
C -1.494145 -3.592232 1.343686
C -3.942302 1.896181 -0.742555
C 3.990627 3.414295 0.098481
H 0.517086 1.038670 -2.169281
H 0.975370 -1.537220 -2.266116
H -0.686722 -0.927079 -2.501361
H 1.551536 -2.517991 0.162307
H -2.500517 -1.680021 -1.158241
H -2.349801 2.593590 0.608425
H -2.837354 0.889369 0.872657
H 4.527102 1.438646 -0.713876
H 3.823221 1.385378 0.933702
H 0.552840 -4.005562 1.965741
H -1.962188 -4.215553 2.114414
H -4.258784 0.960724 -1.234809
H -3.761767 2.658266 -1.519876
H -4.771279 2.244504 -0.099994
H 3.223290 3.852618 0.758542
H 3.933400 3.912751 -0.884276
H 4.984997 3.619785 0.535088


