%chk=000202040.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202040

1 1
O -0.820984 -2.097610 -0.314832
N -2.569610 0.454803 -0.495255
C -2.550474 -0.329630 0.825393
C -2.345897 1.947589 -0.206452
C -1.404510 -0.031934 -1.408287
C -3.519666 0.229978 1.865689
C -3.341062 2.507767 0.810597
C -3.294657 1.720998 2.121972
C -3.904005 0.251105 -1.177796
C -1.373265 -1.568860 -1.538399
C -1.458785 0.617483 -2.782561
C 0.535825 -2.470280 -0.369592
C 1.411436 -1.857224 0.543145
C 0.941332 -3.489865 -1.238297
C 0.950929 -0.798251 1.501016
C 2.743727 -2.302813 0.557667
C 2.272483 -3.908175 -1.201500
C 3.171128 -3.311362 -0.308367
C 1.175612 0.621102 1.049070
C 1.872494 0.937393 -0.124736
C 0.660974 1.660101 1.846222
C 2.049857 2.273689 -0.498921
C 0.844456 2.992033 1.470133
C 1.532039 3.302710 0.291483
H -2.781991 -1.403767 0.623837
H -1.496151 -0.331068 1.223319
H -1.302357 2.075234 0.183215
H -2.403276 2.517336 -1.161757
H -0.448755 0.279115 -0.882819
H -3.391199 -0.341712 2.812657
H -4.572597 0.045892 1.568085
H -4.371252 2.522116 0.401516
H -3.095081 3.576824 0.999511
H -4.063399 2.106165 2.824839
H -2.324550 1.883755 2.634931
H -4.008921 0.884977 -2.075880
H -4.042852 -0.800177 -1.487387
H -4.743288 0.506675 -0.501564
H -2.372084 -2.038340 -1.605740
H -0.780083 -1.877873 -2.421047
H -1.557112 1.711908 -2.747689
H -0.517934 0.430576 -3.332032
H -2.263963 0.231876 -3.422595
H 0.227903 -3.965522 -1.907918
H 1.460580 -0.945075 2.484663
H -0.137424 -0.948164 1.721344
H 3.453253 -1.852027 1.255321
H 2.610912 -4.706906 -1.864294
H 4.211119 -3.642969 -0.283138
H 2.310100 0.146503 -0.735477
H 0.153975 1.431072 2.782126
H 2.611804 2.512235 -1.403385
H 0.469344 3.794056 2.107065
H 1.686703 4.343440 0.006601


%chk=000202040-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202040

1 1
O -0.291037 -1.438083 -0.190055
N -2.726860 0.614271 -0.503491
C -2.544309 -0.074987 0.879162
C -2.862196 2.143612 -0.266086
C -1.433537 0.371687 -1.386004
C -3.639348 0.287754 1.894377
C -3.964905 2.513349 0.739304
C -3.753947 1.812835 2.098501
C -3.966727 0.075565 -1.199638
C -0.989716 -1.107064 -1.433131
C -1.598695 0.911612 -2.820224
C 0.837752 -2.304199 -0.268901
C 1.866044 -2.060581 0.681629
C 0.914000 -3.360810 -1.200862
C 1.765253 -0.924138 1.690066
C 2.981119 -2.931554 0.666468
C 2.045553 -4.208380 -1.195293
C 3.079977 -3.996246 -0.259053
C 1.615112 0.481223 1.101603
C 2.239707 0.847334 -0.118584
C 0.886582 1.472393 1.809646
C 2.129158 2.163446 -0.623593
C 0.778335 2.793143 1.312601
C 1.394661 3.143196 0.087305
H -2.498828 -1.158515 0.694025
H -1.550344 0.243032 1.234487
H -1.874959 2.472212 0.105262
H -3.047717 2.609580 -1.246360
H -0.642334 0.932515 -0.856169
H -3.365380 -0.210843 2.842587
H -4.618442 -0.138071 1.602869
H -4.967773 2.281142 0.333952
H -3.932008 3.612199 0.858210
H -4.587585 2.047631 2.782333
H -2.829298 2.196255 2.573643
H -4.151608 0.646256 -2.120750
H -3.816818 -0.987285 -1.439958
H -4.834182 0.173035 -0.534413
H -1.838525 -1.802171 -1.601744
H -0.299672 -1.213375 -2.291991
H -1.990812 1.939990 -2.861954
H -0.598474 0.942034 -3.285351
H -2.233507 0.264097 -3.449900
H 0.097531 -3.550198 -1.906378
H 2.676045 -0.942805 2.320450
H 0.916560 -1.107599 2.378135
H 3.788869 -2.765653 1.388872
H 2.108146 -5.033664 -1.911869
H 3.955725 -4.652198 -0.247451
H 2.825260 0.100581 -0.667487
H 0.433082 1.216700 2.776853
H 2.636728 2.432477 -1.556811
H 0.245811 3.554472 1.895137
H 1.333334 4.169694 -0.290277


