%chk=000107041.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107041

0 1
 O   0.9047000      -1.262500      -1.708500    
 O  -0.2214000       1.883500      0.6255000    
 O    1.583000      -3.265700      -2.650000    
 O    4.160100       3.647800      0.6173000    
 N   -4.849600      0.8925000     -5.5999998E-03
 N    5.216600       1.248100     -0.3996000    
 C   0.6468000     -0.7201000     -0.3745000    
 C  -0.8073000     -0.2965000     -0.3094000    
 C    1.594000      0.4410000     -0.1447000    
 C   0.9495000      -1.899200      0.4930000    
 C   -1.147000      0.9624000      0.1988000    
 C    1.332100      -2.972300     -0.2917000    
 C    1.105500       1.653800      0.3540000    
 C   -1.844900      -1.151600     -0.7210000    
 C    1.305500      -2.574100      -1.690800    
 C    2.973900      0.3285000     -0.3907000    
 C   0.8955000      -2.028600       1.872000    
 C   -2.485700       1.354700      0.3033000    
 C   -3.500900      0.4951000     -0.1090000    
 C   -3.180500     -0.7575000     -0.6228000    
 C    1.970800       2.722600      0.6109000    
 C    1.673200      -4.202700      0.2386000    
 C    3.836400       1.397500     -0.1412000    
 C    3.334800       2.594000      0.3618000    
 C    1.235100      -3.261100       2.437700    
 C    1.621500      -4.340800       1.625900    
 C   -5.912100      3.1999999E-03 -0.4321000    
 C   -5.193100       2.190400      0.5416000    
 C   -6.353900     -0.9121000      0.6910000    
 C   -5.219600       3.256600     -0.5340000    
 C    4.377100       4.573200     -0.4457000    
 H   -1.623300      -2.140500      -1.114700    
 H    3.381700     -0.6039000     -0.7755000    
 H   0.5979000      -1.198700       2.503900    
 H   -2.673200       2.348900      0.6947000    
 H   -3.918100      -1.483300     -0.9456000    
 H    1.577400       3.657700       1.003100    
 H    1.970800      -5.033600     -0.3908000    
 H    1.200400      -3.386600       3.516500    
 H    1.881700      -5.290800       2.084500    
 H   -6.783000      0.6076000     -0.7207000    
 H   -5.677100     -0.5542000      -1.344900    
 H   -6.203200       2.137000      0.9703000    
 H   -4.571600       2.484600       1.394000    
 H    5.850300       2.013700     -0.2130000    
 H    5.572200      0.3763000     -0.7688000    
 H   -5.544500      -1.572700       1.017000    
 H   -6.684600     -0.3383000       1.563300    
 H   -7.189300      -1.538900      0.3633000    
 H   -4.235900       3.393400     -0.9936000    
 H   -5.924200       2.997100      -1.331300    
 H   -5.529700       4.216600     -0.1092000    
 H    3.439200       5.067500     -0.7184000    
 H    4.803500       4.070800      -1.319600    
 H    5.084100       5.332200     -9.9900000E-02


%chk=000107041-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107041

0 1
O 0.815225 -1.179887 -1.898204
O -0.178305 2.099057 -0.178438
O 1.406458 -3.122051 -3.056363
O 4.472645 3.530239 0.170600
N -4.872129 0.963507 0.025882
N 5.340384 1.005180 0.117060
C 0.657918 -0.736457 -0.372526
C -0.770942 -0.301275 -0.185877
C 1.633419 0.398320 -0.160677
C 1.026342 -2.035753 0.340392
C -1.135210 1.067714 -0.150837
C 1.339296 -3.051665 -0.583094
C 1.186049 1.735613 -0.120375
C -1.840034 -1.233815 -0.135159
C 1.211877 -2.527997 -1.974947
C 3.030591 0.157398 -0.076255
C 1.075391 -2.290019 1.723575
C -2.471124 1.501022 -0.084835
C -3.536129 0.555272 -0.040286
C -3.179652 -0.838529 -0.057854
C 2.090281 2.816096 -0.007689
C 1.709058 -4.347510 -0.169784
C 3.965066 1.206235 0.036835
C 3.465159 2.553264 0.065136
C 1.446587 -3.586919 2.153596
C 1.761052 -4.608872 1.217764
C -5.983451 -0.005824 -0.045184
C -5.238096 2.388903 0.140056
C -6.369808 -0.610030 1.325874
C -5.320813 3.119085 -1.222111
C 4.052260 4.931612 0.177895
H -1.606878 -2.304222 -0.160593
H 3.393538 -0.875796 -0.115574
H 0.832477 -1.505218 2.447412
H -2.647215 2.578461 -0.084049
H -3.951847 -1.609745 -0.006299
H 1.686436 3.830851 0.019024
H 1.944371 -5.115006 -0.914437
H 1.491902 -3.807965 3.225977
H 2.043990 -5.603735 1.578713
H -6.858546 0.517631 -0.474491
H -5.729841 -0.810116 -0.760333
H -6.219030 2.445849 0.648892
H -4.518357 2.901986 0.805087
H 5.953398 1.813458 0.168759
H 5.736601 0.073733 0.049697
H -5.520060 -1.153479 1.774394
H -6.673798 0.183704 2.032233
H -7.215069 -1.314961 1.215908
H -4.353014 3.081925 -1.751032
H -6.079875 2.649070 -1.873481
H -5.599647 4.179766 -1.078887
H 3.401683 5.146959 1.047515
H 3.520180 5.190737 -0.757598
H 4.980836 5.516199 0.253695


