%chk=000160749.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160749

0 1
 O    3.935200      0.2283000      -1.041800    
 O    3.604400     -0.6905000       2.496000    
 O    6.172700      -1.875300       1.699000    
 O    7.486000     -0.2449000     -0.2815000    
 O    5.005600       1.597000      -3.169100    
 O    1.534600       2.177400       1.112000    
 O    2.247700      -2.141100     -0.7855000    
 O   -2.198400     -0.6163000     -0.1847000    
 O  -0.9455000       2.924300       1.394500    
 O   -8.496800      -1.064600     -0.5117000    
 C    4.057300     -0.8435000       1.151100    
 C    5.582300     -0.7098000       1.120800    
 C    3.393500      0.2364000      0.2829000    
 C    6.100900     -0.5792000     -0.3111000    
 C    5.335600      0.5074000      -1.068800    
 C    1.895700      3.0300001E-02  0.1687000    
 C    5.759800      0.5820000      -2.531900    
 C    1.017200       1.027400      0.5944000    
 C    1.400400      -1.160200     -0.3653000    
 C  -0.3601000      0.8244000      0.4823000    
 C   2.3900000E-02  -1.358900     -0.4759000    
 C  -0.8567000     -0.3640000     -5.0600000E-02
 C   -1.311100       1.857300      0.9210000    
 C   -3.097800      0.3517000      0.2358000    
 C   -2.743500       1.536700      0.7579000    
 C   -4.513700     -1.9600000E-02  4.0600002E-02
 C   -5.469200      0.9673000     -0.2133000    
 C   -4.903400      -1.359400      0.1080000    
 C   -6.806500      0.6165000     -0.3985000    
 C   -6.240600      -1.710200     -7.7399999E-02
 C   -7.192300     -0.7222000     -0.3305000    
 C   -9.417100     -4.6000001E-03 -0.7674000    
 H    3.809000      -1.865800      0.8592000    
 H    5.912300      0.1407000       1.730300    
 H    3.605600       1.217500      0.7247000    
 H    6.007100      -1.545400     -0.8220000    
 H    5.502800       1.495000     -0.6176000    
 H    5.561600     -0.3595000      -3.055000    
 H    6.821100      0.8258000      -2.634300    
 H    3.972400      -1.422500       3.018700    
 H    5.917200      -1.901800       2.636300    
 H    7.578000      0.6157000      0.1619000    
 H  -0.3599000      -2.286900     -0.8923000    
 H    4.064900       1.371500      -3.068500    
 H   0.8281000       2.786100       1.375400    
 H    3.066300      -1.734800      -1.116400    
 H   -3.448500       2.286600       1.097300    
 H   -5.204800       2.018200     -0.2959000    
 H   -4.184400      -2.149100      0.3120000    
 H   -7.492700       1.433100     -0.5964000    
 H   -6.535700      -2.754400     -2.1800000E-02
 H   -9.480200      0.6867000      7.9800002E-02
 H   -10.40710     -0.4574000     -0.8849000    
 H   -9.187300      0.5097000      -1.706800    


%chk=000160749-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000160749

0 1
O 4.129777 -0.161282 -1.170127
O 3.528215 0.239260 2.553898
O 6.178006 -0.788469 2.438219
O 7.659496 -0.354505 0.018118
O 5.596012 0.359105 -3.643460
O 1.534553 1.797723 1.576744
O 2.166470 -1.635024 -1.837952
O -2.264990 -0.382432 -0.529712
O -0.789920 2.430573 2.185012
O -8.564568 -0.974593 -0.961181
C 4.037996 -0.308562 1.296642
C 5.563556 -0.094698 1.305803
C 3.429305 0.369408 0.032842
C 6.224963 -0.638432 0.035692
C 5.604994 0.070041 -1.182523
C 1.935145 0.134150 -0.141583
C 6.107790 -0.442003 -2.531000
C 1.045012 0.894676 0.641315
C 1.371631 -0.827010 -1.046595
C -0.371140 0.749884 0.525431
C -0.031243 -1.001208 -1.175173
C -0.873691 -0.207979 -0.392713
C -1.271603 1.551706 1.336968
C -3.154708 0.383618 0.242204
C -2.683931 1.321561 1.150868
C -4.559153 0.056940 -0.044452
C -5.620980 0.713191 0.635690
C -4.891563 -0.932968 -1.017882
C -6.965812 0.403821 0.364945
C -6.226604 -1.249727 -1.297029
C -7.274493 -0.584072 -0.607983
C -9.694360 -0.325097 -0.283165
H 3.811838 -1.393730 1.274857
H 5.762008 0.998471 1.380577
H 3.617478 1.462863 0.096009
H 6.042570 -1.734222 -0.023403
H 5.778324 1.163246 -1.113641
H 5.844528 -1.516307 -2.645276
H 7.203228 -0.339445 -2.559980
H 2.841551 0.955112 2.375245
H 5.662801 -0.533365 3.248153
H 8.015150 -0.603223 0.911162
H -0.420456 -1.738650 -1.878721
H 4.605302 0.350556 -3.605191
H 0.660346 2.263919 2.017177
H 3.127226 -1.319539 -1.737174
H -3.378682 1.912367 1.748806
H -5.406935 1.477189 1.389601
H -4.087966 -1.447830 -1.549786
H -7.756646 0.928451 0.908187
H -6.488375 -2.006790 -2.041676
H -9.667253 -0.513959 0.806816
H -10.591091 -0.787890 -0.718781
H -9.703209 0.764284 -0.477124


