%chk=000292157.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292157

0 1
O -2.988232 1.716585 -0.570246
O 0.748395 1.904351 1.971875
O -2.889911 1.599542 1.686557
O -0.185240 -0.156852 2.131749
O 3.616403 -1.539974 0.692338
N 2.331817 -2.026372 0.482516
C -0.510140 0.617841 -0.933215
C -0.836765 1.435592 0.346457
C -0.819794 -0.856973 -0.798092
C 0.928330 0.871084 -1.335197
C 0.195408 -1.794909 -0.523358
C 1.941026 -0.058609 -1.028425
C 1.586955 -1.309706 -0.316455
C -2.134925 -1.303072 -0.984021
C 1.251507 2.047408 -2.024963
C -2.322014 1.554354 0.625779
C -0.100063 0.901087 1.569274
C -0.115734 -3.161267 -0.444601
C 3.263099 0.199837 -1.421712
C -2.440054 -2.663335 -0.898894
C 2.571194 2.298507 -2.409261
C -1.430457 -3.593034 -0.632191
C 3.576461 1.374443 -2.109005
C -4.441584 1.904822 -0.522466
C 1.673763 1.628136 3.075573
C -5.123709 0.587706 -0.224381
C 3.002422 1.211915 2.483257
H -1.176699 1.027319 -1.750494
H -0.470452 2.495337 0.167426
H -2.930210 -0.579792 -1.189700
H 0.473855 2.770361 -2.267752
H 0.671032 -3.885873 -0.225774
H 4.050819 -0.521768 -1.188256
H -3.465998 -2.999692 -1.039483
H 2.815282 3.215157 -2.944909
H -1.667862 -4.653497 -0.564821
H 4.604597 1.568737 -2.410542
H -4.667203 2.682446 0.228766
H -4.629918 2.276633 -1.546397
H 1.708265 2.608835 3.582905
H 1.233618 0.859438 3.736917
H -6.205746 0.645780 -0.389817
H -4.727713 -0.223049 -0.853870
H -4.966113 0.284789 0.823702
H 3.781112 1.145503 3.250730
H 2.940595 0.229168 1.986907
H 3.340613 1.923285 1.717650
H 3.996964 -2.216725 1.349018


%chk=000292157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292157

0 1
O -3.048639 1.838953 -0.537891
O 0.752272 2.051608 1.952225
O -2.854221 1.344578 1.733719
O -0.086111 -0.125843 2.091520
O 3.826765 -1.730500 0.445487
N 2.443754 -2.197195 0.310166
C -0.496575 0.518131 -0.995034
C -0.832833 1.403586 0.285481
C -0.785671 -0.965713 -0.824823
C 0.943444 0.790581 -1.416348
C 0.261212 -1.879328 -0.524882
C 2.004758 -0.103772 -1.076926
C 1.665452 -1.385557 -0.400686
C -2.106670 -1.451540 -0.975342
C 1.228655 1.981115 -2.124146
C -2.329252 1.482620 0.610420
C -0.045606 0.986147 1.528489
C -0.039996 -3.258146 -0.363163
C 3.334700 0.236589 -1.464479
C -2.400912 -2.819718 -0.809842
C 2.545844 2.305120 -2.506758
C -1.359921 -3.726308 -0.496296
C 3.600468 1.424345 -2.172763
C -4.514765 2.089957 -0.345833
C 1.619399 1.799608 3.148587
C -5.319130 0.789367 -0.411649
C 2.982442 1.253358 2.716026
H -1.172771 0.919903 -1.772210
H -0.525798 2.435629 0.031510
H -2.905342 -0.747189 -1.230117
H 0.403943 2.656086 -2.385241
H 0.776924 -3.947941 -0.134789
H 4.150555 -0.439300 -1.210013
H -3.428623 -3.179340 -0.932172
H 2.747691 3.227400 -3.062412
H -1.577333 -4.792531 -0.369703
H 4.628896 1.660967 -2.466877
H -4.652827 2.593334 0.627253
H -4.765058 2.776690 -1.170129
H 1.698811 2.791015 3.622838
H 1.092254 1.096005 3.816560
H -6.396182 1.019358 -0.311034
H -5.170295 0.274330 -1.376892
H -5.035032 0.110866 0.409697
H 3.637716 1.155324 3.602077
H 2.885515 0.261001 2.245768
H 3.470850 1.934474 1.997982
H 4.204240 -2.416624 1.053744


