%chk=000038290.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038290

0 1
 O  -0.5447000      -1.525200      -1.180800    
 O   -2.515400      -1.148100      -3.105800    
 O    1.714000      0.2606000     -0.6876000    
 O    2.833700       2.578800      -1.736300    
 N   -3.100300      0.5031000      0.1541000    
 C   -3.002600       1.903900      0.5642000    
 C   -2.811400      0.3611000      -1.264300    
 C   -2.847000      -1.101100      -1.715100    
 C   -3.341800       2.075700       2.053400    
 C   -1.870200      -1.993200     -0.9520000    
 C   -1.586900       2.403000      0.2784000    
 C   -4.749400       1.619300       2.415600    
 C   0.3581000      -1.715300     -0.1692000    
 C    1.426100     -0.8511000      4.6300001E-02
 C    2.362200      -1.012500       1.062600    
 C   0.2420000      -2.800400      0.7000000    
 C    3.268400      7.2200000E-02  0.9283000    
 C    2.229800      -2.111500       1.929200    
 C    2.831000      0.8124000     -0.1457000    
 C    1.161600      -2.997600       1.733100    
 C    3.342100       2.000100     -0.7402000    
 C    4.600900       2.665600     -0.1682000    
 H   -3.713600       2.510600     -1.2000000E-02
 H   -1.823200      0.7429000      -1.539200    
 H   -3.534500      0.9329000      -1.860700    
 H   -3.860200      -1.504900      -1.603000    
 H   -4.035300      0.1450000      0.3417000    
 H   -2.620200       1.527500       2.672400    
 H   -3.244800       3.135000       2.322700    
 H   -1.934200      -3.016900      -1.339700    
 H   -2.142400      -1.993800      0.1104000    
 H   -1.410100       3.356000      0.7914000    
 H  -0.8235000       1.702100      0.6356000    
 H   -1.415600       2.604400     -0.7836000    
 H   -4.971100       1.884100       3.454800    
 H   -4.860700      0.5349000       2.324600    
 H   -5.496300       2.102200       1.777700    
 H   -3.173500     -0.6132000      -3.581800    
 H  -0.5449000      -3.541600      0.5864000    
 H    4.132000      0.2796000       1.545000    
 H    2.937500      -2.278500       2.735500    
 H    1.052400      -3.855000       2.392400    
 H    4.421900       2.956800      0.8702000    
 H    4.843200       3.561100     -0.7479000    
 H    5.442300       1.970100     -0.2274000    


%chk=000038290-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038290

0 1
O -0.637794 -1.171885 -0.702574
O -2.622300 -1.551621 -2.881387
O 1.698386 0.482438 -0.527738
O 2.605954 3.012287 -1.368608
N -3.480323 0.547785 0.151631
C -3.070633 1.848070 0.757353
C -3.009329 0.273974 -1.217378
C -2.939550 -1.249119 -1.476402
C -3.965498 2.145940 1.986476
C -1.886073 -1.952311 -0.623516
C -1.581897 1.810730 1.165379
C -5.450647 2.421886 1.657891
C 0.453751 -1.621438 0.022614
C 1.590968 -0.780830 0.069018
C 2.789660 -1.120144 0.760517
C 0.556094 -2.845493 0.725705
C 3.679454 0.002973 0.564659
C 2.877224 -2.361118 1.451567
C 3.003605 0.947721 -0.205166
C 1.750699 -3.199807 1.421377
C 3.394780 2.282829 -0.701639
C 4.815188 2.731122 -0.358282
H -3.211765 2.685565 0.026845
H -1.997627 0.690179 -1.347151
H -3.660141 0.732991 -2.007050
H -3.923218 -1.704757 -1.216200
H -4.493191 0.395796 0.240865
H -3.883234 1.293961 2.691288
H -3.543035 3.028876 2.503421
H -1.720114 -2.972902 -1.019428
H -2.226008 -1.987173 0.429051
H -1.265938 2.797613 1.552233
H -1.427488 1.051947 1.954580
H -0.921967 1.555960 0.318430
H -6.007555 2.708465 2.568689
H -5.964390 1.537457 1.234288
H -5.547415 3.248108 0.928468
H -3.030950 -0.861260 -3.462779
H -0.288773 -3.539792 0.737923
H 4.693022 0.102748 0.949000
H 3.784617 -2.649530 1.989898
H 1.777797 -4.161641 1.944937
H 4.973879 2.748740 0.735627
H 4.974794 3.742030 -0.762888
H 5.562380 2.043731 -0.796043


