%chk=000158088.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158088

0 1
 O   0.4216000      -1.555500       1.886300    
 O   -1.480500       3.096300      0.1069000    
 O   -3.855000       2.782400      0.2338000    
 O    3.511300      -1.267200      0.4221000    
 O    4.720400       1.071400     -0.3611000    
 N   -1.301800      -3.091000      6.7299999E-02
 C  -0.6293000      -1.822300     -0.3182000    
 C   -1.531600     -0.5890000     -0.1688000    
 C   0.6780000      -1.591200      0.4842000    
 C   -2.939300     -0.7504000     -9.3300000E-02
 C  -0.9375000      0.7044000     -0.1530000    
 C   -2.604500      -3.194700     -0.6074000    
 C   -3.552100      -2.123600     -7.8400001E-02
 C    1.336200     -0.2874000      9.1100000E-02
 C   0.5360000      0.8289000     -0.2415000    
 C   -1.815600       1.777100     -6.0999999E-03
 C   -3.771800      0.3654000      3.9400000E-02
 C   -3.182100       1.608000      8.2699999E-02
 C  -0.4949000      -4.269400     -0.2680000    
 C    2.737800     -0.2005000      6.4400002E-02
 C    1.196100       1.997900     -0.6593000    
 C    3.362500      0.9787000     -0.3266000    
 C    2.591900       2.073600     -0.6977000    
 C   -2.768600       3.722500      0.2378000    
 C    4.401900      -1.778300     -0.5657000    
 C    5.371000       1.513800      0.8289000    
 H  -0.3758000      -1.872400      -1.388900    
 H    1.368100      -2.417900      0.2918000    
 H   -3.065100      -4.171500     -0.4127000    
 H   -2.489900      -3.103400      -1.696200    
 H   -3.837100      -2.360800      0.9546000    
 H   -4.465200      -2.130500     -0.6859000    
 H   -4.848300      0.2572000      0.1216000    
 H   0.4161000      -4.316800      0.3353000    
 H  -0.2188000      -4.293700      -1.328200    
 H   -1.043500      -5.190400     -3.7700001E-02
 H   0.6445000       2.876000     -0.9821000    
 H    1.229400      -1.256300       2.337400    
 H    3.067600       2.995500      -1.022000    
 H   -2.905200       4.424000     -0.5932000    
 H   -2.792000       4.284300       1.178500    
 H    4.436900      -2.866300     -0.4552000    
 H    5.410700      -1.391100     -0.3980000    
 H    4.070100      -1.551800      -1.585200    
 H    6.449300       1.518500      0.6480000    
 H    5.158700      0.8347000       1.660600    
 H    5.053700       2.530200       1.083100    


%chk=000158088-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158088

0 1
O 0.473888 -1.628067 1.875931
O -1.562111 3.203446 -0.189401
O -3.920273 2.880756 -0.012103
O 3.527345 -1.224090 0.386732
O 4.754358 1.305727 -0.355984
N -1.274781 -3.060782 0.046116
C -0.620139 -1.787896 -0.321646
C -1.557624 -0.586188 -0.172575
C 0.714811 -1.569996 0.417634
C -2.958304 -0.762712 -0.070438
C -0.962956 0.724944 -0.213103
C -2.587970 -3.199895 -0.615952
C -3.556119 -2.160688 -0.029903
C 1.333234 -0.240467 0.013807
C 0.506959 0.882331 -0.293108
C -1.858619 1.806120 -0.139694
C -3.831174 0.361585 0.000931
C -3.250336 1.624870 -0.029752
C -0.408412 -4.242571 -0.088553
C 2.742490 -0.105076 -0.000108
C 1.126417 2.110115 -0.654476
C 3.349058 1.141023 -0.321844
C 2.529061 2.233202 -0.670711
C -2.837484 3.871587 0.177155
C 4.401824 -1.763581 -0.682457
C 5.421800 1.191765 0.962034
H -0.315353 -1.818364 -1.411630
H 1.421474 -2.374723 0.140486
H -2.969909 -4.219041 -0.425264
H -2.516605 -3.071554 -1.728655
H -3.767781 -2.438728 1.020789
H -4.517246 -2.179164 -0.579475
H -4.914580 0.233864 0.075777
H 0.398563 -4.210193 0.662493
H 0.053420 -4.349612 -1.104807
H -1.007459 -5.148446 0.109639
H 0.508006 2.973681 -0.906756
H 1.347729 -1.470671 2.318689
H 3.011664 3.179075 -0.936342
H -3.002039 4.722405 -0.500293
H -2.793498 4.165820 1.244300
H 4.961733 -2.588769 -0.216426
H 5.091190 -0.984072 -1.052176
H 3.786633 -2.147931 -1.518284
H 6.496296 1.315383 0.757942
H 5.225412 0.206087 1.421232
H 5.071709 1.996890 1.635628


