%chk=000040766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040766

0 1
 N    5.337000     -0.1945000      0.5566000    
 C   0.6626000      -1.517700     -0.7781000    
 C  -0.5060000      -2.478300     -0.5431000    
 C    1.834300      -1.739100      0.1852000    
 C   -1.700100      -2.214500      -1.467100    
 C    3.017500     -0.8000000     -7.2999999E-02
 C   -2.898500      -3.126500      -1.182400    
 C    4.210100      -1.072600      0.8468000    
 C   -3.444900      -2.966300      0.2405000    
 C   -3.893100      -1.565000      0.5404000    
 C  -0.9154000       3.694800     -0.5936000    
 C  -0.3906000       2.359900      -1.132200    
 C    6.587200     -0.7824000       1.041300    
 C    5.130700       1.124900       1.156600    
 C   -1.503800       3.582600      0.8164000    
 C   -3.373000     -0.8089000       1.518700    
 C   0.2121000       2.524800      -2.527700    
 C   -3.817500      0.5934000       1.815800    
 C   -2.646000       2.611500      0.8973000    
 C   -2.674700       1.562300       1.732600    
 C   0.7720000       1.211600      -3.051000    
 H   0.3033000     -0.4904000     -0.6619000    
 H    1.015200      -1.627700      -1.810400    
 H  -0.1624000      -3.510600     -0.6809000    
 H  -0.8060000      -2.381500      0.5049000    
 H    1.485700      -1.605100       1.216700    
 H    2.174500      -2.778400      9.7800002E-02
 H   -1.998500      -1.161900      -1.397500    
 H   -1.384000      -2.372600      -2.505800    
 H    3.335400     -0.9057000      -1.118300    
 H    2.666700      0.2314000      4.8000000E-02
 H   -2.608800      -4.172500      -1.338500    
 H   -3.690700      -2.906000      -1.908600    
 H    4.503700      -2.117300      0.6754000    
 H    3.907800      -1.010300       1.900500    
 H   -2.716200      -3.320800      0.9776000    
 H   -4.316000      -3.625000      0.3484000    
 H   -4.684100      -1.159700     -8.5900001E-02
 H  -0.1003000       4.428700     -0.5751000    
 H   -1.678700       4.087900      -1.277200    
 H   0.3708000       1.968500     -0.4467000    
 H   -1.198800       1.621000      -1.179900    
 H    7.436200     -0.1316000      0.8040000    
 H    6.572000     -0.9493000       2.124600    
 H    6.782300      -1.739900      0.5455000    
 H    5.028800       1.074300       2.246900    
 H    5.976100       1.783400      0.9257000    
 H    4.243300       1.618600      0.7485000    
 H   -1.867100       4.569600       1.126700    
 H  -0.7071000       3.306300       1.518000    
 H  -0.5535000       2.891900      -3.221100    
 H    1.013600       3.272000      -2.503600    
 H   -2.590900      -1.223400       2.150900    
 H   -4.634400      0.8942000       1.148600    
 H   -4.221100      0.6208000       2.835000    
 H   -3.490700       2.792600      0.2371000    
 H   -1.834300       1.393300       2.402200    
 H    1.586600      0.8536000      -2.414800    
 H  -5.1000002E-03  0.4425000      -3.097100    
 H    1.171500       1.348300      -4.060900    


%chk=000040766-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040766

0 1
N 5.788280 -0.700095 0.595206
C 0.910677 -1.609559 -0.620303
C -0.316149 -2.523978 -0.404452
C 2.134848 -2.006844 0.234208
C -1.520110 -2.129419 -1.290936
C 3.347241 -1.071251 0.022566
C -2.763885 -3.034647 -1.115618
C 4.558264 -1.478213 0.886224
C -3.455873 -2.914651 0.274829
C -4.030657 -1.535537 0.525392
C -1.489035 3.965038 -0.784378
C -0.651926 2.731272 -1.189203
C 6.983461 -1.316917 1.206428
C 5.673376 0.727204 0.956608
C -2.107110 3.864813 0.638673
C -3.673737 -0.701935 1.536690
C -0.077274 2.836676 -2.620491
C -4.237475 0.694492 1.755052
C -3.167420 2.788137 0.755402
C -3.164750 1.769341 1.653666
C 0.772935 1.612407 -3.023491
H 0.625593 -0.561316 -0.390740
H 1.194955 -1.623819 -1.693591
H -0.034179 -3.577244 -0.616067
H -0.606583 -2.486872 0.665236
H 1.848432 -2.005951 1.307330
H 2.427451 -3.049951 -0.008892
H -1.801881 -1.078479 -1.074931
H -1.202360 -2.159120 -2.353951
H 3.656783 -1.086262 -1.040961
H 3.037428 -0.032275 0.252876
H -2.474466 -4.093022 -1.280585
H -3.507878 -2.786394 -1.900405
H 4.788223 -2.543442 0.685494
H 4.276150 -1.408772 1.972412
H -2.742056 -3.175761 1.079317
H -4.270844 -3.667191 0.319149
H -4.787860 -1.192097 -0.199383
H -0.852386 4.872029 -0.837855
H -2.304466 4.112230 -1.523486
H 0.182638 2.602976 -0.467405
H -1.275928 1.818123 -1.106458
H 7.887822 -0.760203 0.900556
H 6.953867 -1.334943 2.327111
H 7.087458 -2.358172 0.851954
H 5.481126 0.889089 2.049844
H 6.611152 1.249026 0.694144
H 4.854801 1.202765 0.391029
H -2.557381 4.847918 0.892501
H -1.304477 3.681305 1.380699
H -0.914545 2.958421 -3.338273
H 0.536331 3.757766 -2.701310
H -2.906315 -1.033063 2.255199
H -5.040434 0.894956 1.020506
H -4.702494 0.743010 2.763784
H -4.002974 2.859782 0.038865
H -2.325829 1.686348 2.363450
H 1.636639 1.486795 -2.342880
H 0.174927 0.682807 -2.974795
H 1.164579 1.711871 -4.052758


