%chk=000146622.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146622

0 1
 O    2.361000      0.2571000     -0.6378000    
 O    3.112000      -2.312000       1.872200    
 O    5.717700      -1.232400       1.211200    
 O    5.530900       1.591900      0.6417000    
 O    4.235700       3.165500      -1.200600    
 O    2.823000       1.930900      -2.495000    
 N    1.087700      -1.628700     -8.5000001E-02
 N   -1.110400      -2.292900     -0.5898000    
 N  -0.8522000     -0.2458000      0.2340000    
 N   -3.091800       1.570300      0.6884000    
 N   -5.662900      0.6600000      4.6200000E-02
 C    3.361300      -1.464400      0.7516000    
 C    4.490200     -0.5051000       1.130300    
 C    2.088100     -0.6964000      0.3875000    
 C    4.656200      0.6061000      9.4700001E-02
 C    3.308900       1.239700     -0.2345000    
 C  -0.2658000      -1.343600     -0.1264000    
 C    3.405900       2.120300      -1.437900    
 C   -2.372300      -1.761200     -0.5254000    
 C   -2.187000     -0.4836000     -8.7000001E-03
 C   -3.314800      0.3371000      0.1839000    
 C  -0.7799000      -3.617900      -1.067100    
 C   -3.623600      -2.270300     -0.8630000    
 C   -4.596600     -0.1372000     -0.1439000    
 C   -4.724600      -1.426800     -0.6590000    
 C   -4.179700       2.339800      0.8651000    
 C   -5.441200       1.892800      0.5498000    
 C   -3.975800       3.706900       1.417500    
 H    3.687700      -2.105000     -7.7100001E-02
 H    4.314700     -8.2999997E-02   2.128200    
 H    1.700900     -0.1762000       1.274300    
 H    5.130500      0.2093000     -0.8122000    
 H    2.900600       1.832500      0.5932000    
 H    1.434100      -2.514000     -0.4455000    
 H    2.792600      -1.757700       2.604600    
 H    6.391100     -0.6364000       1.579700    
 H    6.415500       1.195800      0.7133000    
 H  -0.1322000      -3.516200      -1.942000    
 H  -0.2659000      -4.155200     -0.2656000    
 H   -1.682200      -4.164400      -1.345300    
 H   -3.759800      -3.267300      -1.265500    
 H   -5.714400      -1.802200     -0.9157000    
 H    4.314300       3.755400      -1.980400    
 H   -6.324800       2.505100      0.6881000    
 H   -4.330000       4.461500      0.7082000    
 H   -4.518200       3.821400       2.361400    
 H   -2.915300       3.897800       1.612200    


%chk=000146622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146622

0 1
O 3.325684 -0.556563 -1.274145
O 1.043664 1.747026 0.669385
O 3.319779 1.270761 2.490529
O 5.759665 1.175669 1.003143
O 5.606568 -1.123201 -2.699178
O 6.787340 -0.841811 -0.727677
N 1.055111 -0.567705 -1.475990
N -1.097700 -1.667287 -1.525005
N -0.842767 0.096028 -0.089553
N -3.074682 1.092670 1.726771
N -5.581209 -0.305613 1.494701
C 2.016813 0.688005 0.535742
C 3.367638 1.240345 1.031013
C 2.131682 0.283954 -0.969072
C 4.583950 0.403270 0.591266
C 4.552327 0.171998 -0.935613
C -0.236534 -0.678489 -1.017414
C 5.750710 -0.643532 -1.408870
C -2.340863 -1.489360 -0.877363
C -2.150965 -0.399355 0.017743
C -3.229051 0.036085 0.845089
C -0.758614 -2.691247 -2.513779
C -3.571492 -2.184576 -1.006630
C -4.488884 -0.678348 0.718367
C -4.637106 -1.770044 -0.200123
C -4.149593 1.435371 2.472555
C -5.399531 0.723047 2.342912
C -4.006853 2.583612 3.443336
H 1.759930 -0.213319 1.133548
H 3.490362 2.266034 0.618128
H 2.214302 1.226116 -1.561676
H 4.556457 -0.582600 1.100007
H 4.583615 1.158185 -1.456009
H 1.323315 -1.088711 -2.312604
H 0.123204 1.300398 0.550862
H 4.180217 1.659846 2.796434
H 6.558611 0.602018 0.855447
H -0.755377 -2.287351 -3.543962
H 0.230902 -3.129934 -2.290503
H -1.499818 -3.503671 -2.462969
H -3.696228 -3.014135 -1.710259
H -5.613739 -2.260354 -0.245399
H 6.421775 -1.636736 -2.955516
H -6.261243 1.015388 2.955036
H -4.709305 3.403406 3.201319
H -4.224452 2.262645 4.479316
H -2.978414 2.973365 3.400562


