%chk=000092510.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092510

0 1
 O    4.342900     -0.1037000      0.7895000    
 N   -2.544100       1.001500      0.4932000    
 C  -0.4993000      -1.087000      0.2906000    
 C   -1.551800     -0.8378000     -0.8392000    
 C   -1.937700      0.6589000     -0.8093000    
 C   -1.100700     -0.6578000       1.654600    
 C   0.7423000     -0.2079000      2.3600001E-02
 C  -0.7077000       1.487700      -1.232700    
 C   -1.668600      0.7680000       1.642700    
 C  -0.1399000      -2.588500      0.3508000    
 C   0.6141000       1.012400     -0.6773000    
 C   -2.808500      -1.722500     -0.7790000    
 C    2.013200     -0.5526000      0.5211000    
 C   -3.118900       2.342700      0.5289000    
 C   0.5000000      -3.037800     -0.9411000    
 C    1.744400       1.818800     -0.8997000    
 C    3.126600      0.2612000      0.2991000    
 C    2.993800       1.444300     -0.4156000    
 H   -1.094900      -1.028100      -1.820900    
 H   -2.709800      0.8231000      -1.573900    
 H  -0.3464000     -0.7294000       2.449300    
 H   -1.903100      -1.350300       1.940700    
 H  -0.8490000       2.547200     -0.9933000    
 H  -0.6290000       1.430500      -2.327600    
 H   -2.237500      0.9068000       2.570800    
 H  -0.8522000       1.499800       1.673900    
 H   -1.025700      -3.201300      0.5532000    
 H   0.5368000      -2.802300       1.186300    
 H   -2.569900      -2.771400     -0.9772000    
 H   -3.318300      -1.667100      0.1868000    
 H   -3.526500      -1.415700      -1.548000    
 H    2.159800      -1.454900       1.107600    
 H   -3.796700       2.500300     -0.3171000    
 H   -2.359100       3.130800      0.5169000    
 H   -3.720600       2.472200       1.435800    
 H  -0.2026000      -3.027600      -1.779200    
 H    1.384900      -2.467900      -1.231600    
 H   0.8251000      -4.079400     -0.8327000    
 H    1.649700       2.750800      -1.452400    
 H    3.851000       2.086500     -0.5970000    
 H    4.997700      0.5728000      0.5452000    


%chk=000092510-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000092510

0 1
O 4.362059 -0.153255 0.851554
N -2.520355 1.026547 0.506794
C -0.485582 -1.085306 0.254265
C -1.561509 -0.825085 -0.861476
C -1.949668 0.677251 -0.824212
C -1.092206 -0.665118 1.637835
C 0.744593 -0.182240 -0.014560
C -0.727203 1.525451 -1.282162
C -1.607905 0.786113 1.648365
C -0.103954 -2.595578 0.334443
C 0.607497 1.058748 -0.708533
C -2.818697 -1.717968 -0.785748
C 2.018949 -0.536081 0.493842
C -3.170331 2.345198 0.560964
C 0.489036 -3.203747 -0.954572
C 1.746252 1.882378 -0.882878
C 3.139036 0.298740 0.310880
C 3.014647 1.522304 -0.386339
H -1.075418 -1.002745 -1.843525
H -2.766945 0.845665 -1.554888
H -0.322851 -0.785814 2.425079
H -1.927464 -1.348674 1.882365
H -0.890720 2.593151 -1.032775
H -0.679740 1.479846 -2.390521
H -2.176001 0.966597 2.582091
H -0.744083 1.496683 1.655866
H -1.009241 -3.162322 0.625717
H 0.606727 -2.745830 1.170802
H -2.575960 -2.793690 -0.840822
H -3.390718 -1.525632 0.137599
H -3.486733 -1.487684 -1.637428
H 2.175387 -1.470305 1.039869
H -3.877795 2.447168 -0.282352
H -2.461727 3.211356 0.520781
H -3.745126 2.434456 1.501751
H -0.238141 -3.182797 -1.786698
H 1.390282 -2.653593 -1.278284
H 0.776238 -4.258783 -0.791281
H 1.633520 2.833329 -1.418769
H 3.881308 2.179574 -0.534736
H 5.084342 0.496994 0.667498


