%chk=000110618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110618

0 1
 O   -4.371000     -0.3002000      4.9000001E-03
 N    6.883200      0.3071000      5.1000002E-03
 C   0.5662000     -0.3978000     -3.7000000E-03
 C    1.881000      0.3874000     -2.0099999E-02
 C  -0.6767000      0.4954000      1.4800000E-02
 C    3.124100     -0.5061000     -1.3200000E-02
 C   -1.959600     -0.3428000      1.1300000E-02
 C    4.406500      0.3329000      9.6000005E-03
 C   -3.213700      0.5229000     -3.3000000E-03
 C    5.679500     -0.5153000      1.6000000E-03
 C   -5.563200      0.4740000     -8.2999999E-03
 C   -6.756300     -0.4577000      1.2000001E-03
 H   0.5517000      -1.053100      0.8762000    
 H   0.5307000      -1.050500     -0.8848000    
 H    1.908900       1.051100      0.8531000    
 H    1.902400       1.031600     -0.9079000    
 H  -0.6660000       1.155000     -0.8611000    
 H  -0.6568000       1.136100      0.9045000    
 H    3.119100      -1.149100     -0.9012000    
 H    3.101000      -1.163300      0.8642000    
 H   -1.983400     -0.9993000      0.8901000    
 H   -1.973400      -1.009300     -0.8601000    
 H    4.403300      0.9732000      0.9010000    
 H    4.411400       1.001900     -0.8607000    
 H   -3.219300       1.151300     -0.9019000    
 H   -3.223800       1.174400      0.8785000    
 H    5.689500      -1.160000     -0.8844000    
 H    5.693900      -1.167200      0.8818000    
 H    7.703700     -0.2937000     -6.0800001E-02
 H    6.895400      0.9003000     -0.8236000    
 H   -5.589900       1.098100     -0.9086000    
 H   -5.594300       1.122000      0.8748000    
 H   -7.693100      0.1065000     -8.6000003E-03
 H   -6.734400      -1.121300     -0.8695000    
 H   -6.738700      -1.097700      0.8896000    


%chk=000110618-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110618

0 1
O -4.420073 -0.285209 0.001068
N 6.961102 0.259739 -0.023966
C 0.580408 -0.394339 -0.011801
C 1.900011 0.409547 -0.015030
C -0.678926 0.501221 -0.008144
C 3.160681 -0.484356 -0.018780
C -1.994055 -0.310914 -0.004988
C 4.476631 0.324687 -0.017246
C -3.236963 0.583972 0.000614
C 5.735264 -0.566191 -0.026860
C -5.676602 0.475978 0.008924
C -6.827437 -0.529991 0.009051
H 0.558381 -1.060072 0.876040
H 0.553585 -1.059942 -0.899699
H 1.926566 1.075341 0.872733
H 1.921127 1.075670 -0.903110
H -0.654810 1.167003 -0.896421
H -0.649933 1.166188 0.880527
H 3.134279 -1.149746 -0.907379
H 3.138595 -1.150640 0.868983
H -2.029780 -0.971933 0.882625
H -2.035898 -0.969161 -0.894425
H 4.523056 0.982187 0.872412
H 4.495616 0.992563 -0.905524
H -3.249546 1.243465 -0.898139
H -3.245061 1.238302 0.903155
H 5.665530 -1.271643 -0.893062
H 5.740516 -1.188659 0.889224
H 7.829019 -0.267331 0.114097
H 7.027116 0.896427 -0.825287
H -5.723832 1.135250 -0.887735
H -5.717039 1.127708 0.911388
H -7.801532 -0.007453 0.015083
H -6.777512 -1.171617 -0.887668
H -6.770585 -1.179252 0.899840


