%chk=000098130.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098130

0 1
 O   0.9303000      -2.184700      0.2301000    
 O    4.647100       1.858200     -0.2780000    
 O    5.442400     -0.7001000      0.4616000    
 N   -4.869800       1.712800     -0.3267000    
 C   -3.200600      5.0799999E-02  0.1821000    
 C   -2.215600       1.047600      0.1781000    
 C    1.415300      0.1150000     -0.2753000    
 C   -4.533200      0.4329000     -7.8599997E-02
 C    1.835900      -1.173800      0.1000000    
 C  -0.8034000      0.7745000      0.4338000    
 C   3.6600001E-02  0.4152000     -0.5328000    
 C    2.384400       1.126000     -0.3970000    
 C    3.731100      0.8579000     -0.1516000    
 C    4.130300     -0.4261000      0.2197000    
 C    3.182700      -1.442000      0.3455000    
 C   -2.885100      -1.294500      0.4377000    
 C   -2.559300       2.367300     -7.7000000E-02
 C   -5.511500     -0.5578000     -7.3899999E-02
 C   -3.883300      -2.264500      0.4361000    
 C   -3.889000       2.644500     -0.3215000    
 C   -5.198000      -1.895400      0.1799000    
 C   0.6633000      -2.967400     -0.9312000    
 C    4.920300       2.637400      0.8850000    
 C    6.229100      -1.133900     -0.6462000    
 H  -0.4802000      0.8677000       1.467200    
 H  -0.2939000      0.3229000      -1.563600    
 H    2.087000       2.132400     -0.6875000    
 H    3.494100      -2.442300      0.6364000    
 H   -1.870100      -1.618600      0.6495000    
 H   -1.824700       3.166000     -8.7600000E-02
 H   -6.549000     -0.2944000     -0.2715000    
 H   -3.636100      -3.302800      0.6354000    
 H   -4.217100       3.658200     -0.5271000    
 H   -5.983300      -2.645700      0.1772000    
 H    1.567200      -3.494400      -1.252500    
 H   0.2842000      -2.343100      -1.746100    
 H  -0.1001000      -3.707700     -0.6762000    
 H    5.316100       2.006800       1.687300    
 H    4.015300       3.152100       1.222900    
 H    5.673000       3.387100      0.6259000    
 H    7.250200      -1.305200     -0.2950000    
 H    6.251500     -0.3671000      -1.426900    
 H    5.836100      -2.071700      -1.051400    


%chk=000098130-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000098130

0 1
O 0.881664 -2.013095 -0.218453
O 4.809677 2.055578 -0.023113
O 5.596938 -0.784966 -0.093352
N -5.098356 1.828215 -0.474228
C -3.607542 -0.119602 0.022025
C -2.434058 0.675578 -0.308627
C 1.464676 0.338248 -0.181523
C -4.914647 0.505084 -0.084353
C 1.888921 -1.036850 -0.185335
C -1.086347 0.089295 -0.253716
C 0.080582 0.815417 -0.216663
C 2.494646 1.321333 -0.121664
C 3.861592 1.002407 -0.081599
C 4.252500 -0.364768 -0.136266
C 3.261483 -1.369343 -0.170186
C -3.545882 -1.483213 0.461412
C -2.664582 2.009900 -0.706049
C -6.090231 -0.252142 0.225967
C -4.708824 -2.198754 0.760425
C -3.985871 2.534420 -0.765338
C -5.993287 -1.581895 0.638672
C 1.287613 -3.422360 -0.228875
C 5.553478 2.118482 1.257222
C 6.465907 -0.257839 -1.175174
H -1.005053 -0.998469 -0.238255
H 0.000685 1.912382 -0.192603
H 2.222114 2.382383 -0.094094
H 3.607295 -2.405690 -0.196810
H -2.574492 -1.973374 0.579499
H -1.832697 2.654691 -1.005656
H -7.053001 0.258833 0.127959
H -4.637809 -3.239485 1.096026
H -4.145432 3.574168 -1.076704
H -6.896982 -2.154289 0.875394
H 1.860570 -3.679651 0.682260
H 1.887053 -3.658667 -1.128534
H 0.346370 -3.991008 -0.250861
H 6.103223 1.177018 1.441915
H 4.856918 2.314079 2.094439
H 6.255993 2.958893 1.149168
H 7.479303 -0.609200 -0.929375
H 6.429624 0.844715 -1.210705
H 6.146467 -0.676360 -2.148070


