%chk=000225116.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225116

0 1
O 5.831599 0.009256 -0.374906
N -1.711271 -0.851310 0.945463
N -3.930001 -1.767555 -0.703093
N -3.248407 2.496306 0.141966
N 0.284312 0.088555 0.052995
C -2.539536 0.125696 0.171340
C -3.970529 -0.428643 -0.027373
C -2.581454 1.448717 0.982845
C -0.324688 -0.913100 0.720692
C -3.513573 -1.640714 -2.131801
C -5.268593 -2.426639 -0.615014
C -2.277747 3.091192 -0.826202
C -3.835699 3.565872 1.003961
C 0.409402 -2.022200 1.308121
C 1.670850 0.059908 -0.044123
C 2.457335 -0.987429 0.513205
C 1.768839 -2.044697 1.201135
C 3.868599 -0.957758 0.373283
C 2.315587 1.133363 -0.742526
C 4.452695 0.096743 -0.307784
C 3.681897 1.154495 -0.873863
C 6.545400 1.061198 -1.063214
H -2.072455 0.326468 -0.832254
H -4.562221 0.336409 -0.580908
H -4.467581 -0.548094 0.959470
H -1.545771 1.721734 1.286792
H -3.148642 1.295721 1.923337
H -2.172432 -1.757122 1.087863
H -3.454706 -2.644815 -2.580120
H -4.176289 -1.020832 -2.752984
H -2.499516 -1.208194 -2.174273
H -6.089055 -1.873294 -1.094908
H -5.207621 -3.423514 -1.080409
H -5.526615 -2.580090 0.444669
H -1.482067 3.696760 -0.367938
H -2.831039 3.719531 -1.540413
H -1.790947 2.282685 -1.398837
H -3.113850 4.093272 1.644513
H -4.612381 3.122161 1.646544
H -4.333056 4.310098 0.361735
H -0.136612 -2.805644 1.826631
H 2.356949 -2.857242 1.629516
H 4.483293 -1.749624 0.793985
H 1.690748 1.923993 -1.160887
H 4.172385 1.967039 -1.402494
H 7.587020 0.730263 -0.955418
H 6.388203 2.020858 -0.563040
H 6.254739 1.094718 -2.116877


%chk=000225116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225116

0 1
O 5.923435 0.081741 -0.288751
N -1.743437 -0.940896 0.596813
N -4.095130 -1.805011 -0.545736
N -3.104457 2.571643 0.072061
N 0.277080 0.121138 -0.002154
C -2.565241 0.123642 0.000577
C -4.022392 -0.396746 -0.070459
C -2.501740 1.438913 0.823248
C -0.359258 -0.958614 0.513428
C -3.696832 -1.954566 -1.964417
C -5.415769 -2.415373 -0.277975
C -2.154807 3.176484 -0.888081
C -3.710670 3.593232 0.948833
C 0.353066 -2.130966 0.988324
C 1.664515 0.097999 -0.062292
C 2.456419 -1.030291 0.386069
C 1.736467 -2.159683 0.918900
C 3.874855 -0.988843 0.290238
C 2.349433 1.232714 -0.593078
C 4.516451 0.141828 -0.237239
C 3.746852 1.262618 -0.682899
C 6.632446 1.241327 -0.829262
H -2.185307 0.349493 -1.017847
H -4.612328 0.308631 -0.698792
H -4.454609 -0.378539 0.949500
H -1.439425 1.635140 1.088522
H -3.064305 1.294455 1.765085
H -2.246143 -1.837356 0.663576
H -3.730153 -3.022124 -2.245767
H -4.361353 -1.387359 -2.661469
H -2.662832 -1.597857 -2.107453
H -6.249659 -1.924477 -0.838170
H -5.395960 -3.482672 -0.562874
H -5.644081 -2.350795 0.800789
H -1.307388 3.705344 -0.382397
H -2.686307 3.904002 -1.528505
H -1.717427 2.396775 -1.533383
H -2.969132 4.119120 1.603361
H -4.471412 3.126623 1.599714
H -4.213636 4.359075 0.329770
H -0.212432 -2.974617 1.399315
H 2.293211 -3.036205 1.270480
H 4.483071 -1.835797 0.626158
H 1.744877 2.081088 -0.929376
H 4.239868 2.148568 -1.094856
H 7.698792 0.976231 -0.773535
H 6.444963 2.151293 -0.225559
H 6.353319 1.434170 -1.884036


