%chk=000213758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213758

0 1
O -0.872960 0.025344 0.551454
N -4.463680 -0.175245 -0.110683
C -3.207242 0.079292 0.660571
C 1.430154 0.144770 0.947920
C -2.030576 -0.118442 -0.308969
C 2.821478 0.101912 0.380595
C -4.874583 -1.616222 -0.007326
C -5.572541 0.744718 0.307419
C 0.387326 -0.037753 -0.159378
C 3.447951 1.286925 -0.061075
C 3.513121 -1.124153 0.280179
C -5.814564 -1.973520 -1.159812
C -5.301510 2.159248 -0.207131
C 4.747881 1.238006 -0.587998
C 4.812559 -1.154524 -0.249348
C 2.754149 2.610314 0.023312
C 2.889964 -2.407114 0.733701
C 5.425597 0.022144 -0.680392
H -3.076801 -0.575825 1.548144
H -3.180757 1.120010 1.051394
H 1.236345 1.097373 1.484149
H 1.281725 -0.632258 1.726780
H -2.019573 -1.120822 -0.767275
H -2.010541 0.651861 -1.097245
H -3.959872 -2.246834 -0.076566
H -5.352133 -1.859068 0.966405
H -6.519324 0.369303 -0.143500
H -5.728485 0.759176 1.407597
H 0.473754 -1.016094 -0.661326
H 0.424513 0.770560 -0.909091
H -6.785455 -1.473633 -1.068216
H -5.386883 -1.662540 -2.122977
H -5.993234 -3.052404 -1.201803
H -4.435277 2.616762 0.284575
H -5.086268 2.147518 -1.284367
H -6.165485 2.810250 -0.042100
H 5.230790 2.151792 -0.926060
H 5.345738 -2.099279 -0.324308
H 2.555540 2.887692 1.069036
H 3.342233 3.424832 -0.418249
H 1.786510 2.592971 -0.498191
H 2.703435 -2.395267 1.817675
H 1.924380 -2.584215 0.239025
H 3.521770 -3.280154 0.526638
H 6.434033 -0.008508 -1.089584


%chk=000213758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213758

0 1
O -0.884965 0.055797 0.747530
N -4.534894 -0.151704 -0.067844
C -3.303109 0.093929 0.725396
C 1.517641 0.144258 1.058329
C -2.047677 -0.103082 -0.136075
C 2.895084 0.092750 0.406654
C -4.926742 -1.587336 -0.076745
C -5.653478 0.763481 0.280707
C 0.387400 -0.034359 0.025281
C 3.494466 1.289240 -0.095566
C 3.577992 -1.154918 0.266552
C -5.752358 -1.982836 -1.316124
C -5.448006 2.189537 -0.265178
C 4.758574 1.220954 -0.732587
C 4.841346 -1.189112 -0.375066
C 2.813465 2.642074 0.055451
C 2.987551 -2.449030 0.808492
C 5.432456 -0.010153 -0.875888
H -3.235102 -0.567668 1.620787
H -3.303808 1.132311 1.100310
H 1.353664 1.107981 1.571722
H 1.405249 -0.644868 1.822245
H -2.038708 -1.114057 -0.601833
H -2.027856 0.650047 -0.952817
H -3.997100 -2.187028 -0.068940
H -5.485180 -1.863752 0.854378
H -6.578497 0.349580 -0.160470
H -5.821579 0.802697 1.387296
H 0.471628 -1.020064 -0.485017
H 0.440249 0.755690 -0.756809
H -6.710251 -1.434599 -1.366837
H -5.185122 -1.760865 -2.236824
H -5.987569 -3.063548 -1.294394
H -4.538243 2.660568 0.149821
H -5.345960 2.162905 -1.364027
H -6.308221 2.833403 -0.002025
H 5.215114 2.141447 -1.115942
H 5.362601 -2.148333 -0.479558
H 2.720989 2.935113 1.119112
H 3.391593 3.429720 -0.457109
H 1.791892 2.645879 -0.367549
H 2.891255 -2.422938 1.911135
H 1.978415 -2.651459 0.403672
H 3.629827 -3.308521 0.551214
H 6.409178 -0.050234 -1.371257


