%chk=000032915.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032915

0 1
 O   -2.119600     -0.4463000      -1.071300    
 O   -1.860900      -2.990100      1.6899999E-02
 O    4.858700       2.074100     -0.7628000    
 O    7.087200       1.684700      0.7255000    
 N    5.970800      0.8461000      0.8491000    
 C   -4.754800       1.900500      0.2192000    
 C   -4.144400      0.6755000     -0.4581000    
 C   -6.281200       1.823600      0.2362000    
 C   -2.623200      0.7238000     -0.4418000    
 C   -6.891700       3.025300      0.9398000    
 C  -0.8983000     -0.9007000     -0.6461000    
 C  -0.7765000      -2.174100     -0.1013000    
 C   0.2124000     -7.2300002E-02 -0.7655000    
 C    1.460200     -0.5232000     -0.3351000    
 C   0.4713000      -2.624900      0.3294000    
 C    1.589600      -1.799700      0.2124000    
 C    2.626300      0.3373000     -0.4572000    
 C    3.775800      0.1979000      0.2409000    
 C   -2.606800      -2.905500       1.229600    
 C    4.905000       1.148000      4.0100001E-02
 H   -4.436700       2.809100     -0.3061000    
 H   -4.381400       1.974700       1.248000    
 H   -4.495800      0.5996000      -1.494600    
 H   -4.483000     -0.2413000      4.0500000E-02
 H   -6.602900      0.9084000      0.7466000    
 H   -6.662800       1.774000     -0.7903000    
 H   -2.268400       1.603400     -0.9911000    
 H   -2.269600      0.7921000      0.5952000    
 H   -6.555800       3.083400       1.980100    
 H   -6.614600       3.956900      0.4363000    
 H   -7.983600       2.950500      0.9391000    
 H   0.1075000      0.9192000      -1.199900    
 H   0.5797000      -3.620200      0.7520000    
 H    2.543300      -2.201300      0.5420000    
 H    2.530100       1.155300      -1.167900    
 H    3.916700     -0.5821000      0.9810000    
 H   -2.958600      -1.883600       1.401300    
 H   -3.475100      -3.564500       1.144600    
 H   -1.996100      -3.238000       2.075000    
 H    6.068400      3.9900001E-02   1.456000    
 H    6.925700       2.295600       1.464300    


%chk=000032915-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032915

0 1
O -2.302781 -0.877898 0.108549
O -1.541472 -3.665929 -0.063548
O 4.381295 2.615782 0.391571
O 6.973546 2.273220 0.343563
N 6.105537 1.134017 0.275550
C -4.683145 2.106357 0.199136
C -4.182647 0.644191 0.134643
C -6.225480 2.206664 0.171310
C -2.655824 0.555490 0.169480
C -6.732354 3.663043 0.244500
C -0.941298 -1.224368 0.131067
C -0.623414 -2.619162 0.052908
C 0.107391 -0.282238 0.200288
C 1.476677 -0.674407 0.168340
C 0.738651 -3.006926 0.010414
C 1.774617 -2.062221 0.062451
C 2.499854 0.370328 0.238207
C 3.860912 0.210455 0.221097
C -2.839212 -3.610839 0.641616
C 4.745770 1.381353 0.300274
H -4.265755 2.683819 -0.651920
H -4.304528 2.591728 1.122827
H -4.549610 0.161113 -0.791419
H -4.595581 0.069275 0.986195
H -6.642660 1.624929 1.018302
H -6.604606 1.726347 -0.753366
H -2.205301 1.082667 -0.697083
H -2.252655 0.997386 1.104654
H -6.391906 4.155548 1.174869
H -6.354492 4.258871 -0.607689
H -7.836523 3.707538 0.223762
H -0.123054 0.786046 0.264407
H 0.947595 -4.078689 -0.061850
H 2.813065 -2.406743 0.030980
H 2.145824 1.409019 0.313750
H 4.327758 -0.780295 0.148169
H -3.509116 -2.868306 0.183255
H -3.246667 -4.628359 0.538856
H -2.691682 -3.367913 1.710290
H 6.613912 0.256492 0.192992
H 6.276260 3.013714 0.400602


