%chk=000203103.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203103

0 1
O 1.468552 -0.425823 -0.449562
O 3.352109 1.692798 0.116489
O -0.635059 2.406188 -0.012645
O -2.247123 0.353224 0.984955
O -2.885967 -0.773728 -0.911932
N -4.447706 0.207236 0.533018
C 1.135372 0.986625 -0.642195
C -0.388900 1.045533 -0.409765
C 1.925600 1.851429 0.345097
C -0.854604 0.070614 0.681277
C 2.829288 -0.661304 -0.309716
C 3.746556 0.371337 -0.011448
C 3.260835 -1.981717 -0.452298
C 5.108344 0.091171 0.127268
C -5.676015 -0.327725 -0.136612
C -3.193464 -0.161711 0.088724
C 4.624680 -2.256128 -0.302124
C 5.536934 -1.232029 -0.023419
C -6.702582 0.802865 -0.224308
C -6.216127 -1.527782 0.645267
H 1.398756 1.235361 -1.695250
H -0.948896 0.864548 -1.360336
H 1.766590 2.934646 0.177891
H 1.716166 1.594275 1.396969
H -0.729544 -0.984132 0.366875
H -0.373710 0.244599 1.660875
H -1.511269 2.463412 0.439649
H 2.542265 -2.766286 -0.679677
H -5.381085 -0.656962 -1.172858
H 5.806386 0.895948 0.348068
H -4.551561 0.656518 1.439734
H 4.977435 -3.280715 -0.409479
H 6.595684 -1.464768 0.081361
H -7.591849 0.476844 -0.778105
H -7.042697 1.141780 0.760662
H -6.295451 1.676963 -0.749658
H -5.476649 -2.337512 0.699173
H -7.109917 -1.940506 0.161806
H -6.494377 -1.270086 1.672929


%chk=000203103-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203103

0 1
O 1.480227 -0.362476 -0.499308
O 3.451578 1.548756 0.505788
O -0.537650 2.704903 -0.250544
O -2.403250 0.868731 0.852157
O -2.869873 -1.142893 -0.313332
N -4.563327 0.348955 0.344709
C 1.218933 1.096256 -0.423351
C -0.307190 1.254838 -0.343564
C 2.000434 1.698105 0.753547
C -0.956350 0.521708 0.840890
C 2.853735 -0.690074 -0.386312
C 3.813855 0.245897 0.089246
C 3.256212 -1.986502 -0.764325
C 5.175033 -0.115246 0.152311
C -5.704922 -0.447509 -0.166776
C -3.268643 -0.085483 0.235447
C 4.618120 -2.349862 -0.686164
C 5.578952 -1.410294 -0.238096
C -6.879780 0.499824 -0.477777
C -6.098112 -1.564291 0.828819
H 1.578501 1.569913 -1.358521
H -0.748333 0.849732 -1.277856
H 1.813172 2.778008 0.834354
H 1.746946 1.190978 1.704846
H -0.829713 -0.568939 0.744826
H -0.582938 0.889862 1.809855
H -1.505833 2.835851 -0.079226
H 2.494442 -2.686162 -1.122699
H -5.355904 -0.924100 -1.101564
H 5.894184 0.625291 0.516375
H -4.741455 1.200348 0.880084
H 4.927003 -3.357874 -0.981388
H 6.637345 -1.685758 -0.185809
H -7.727645 -0.072213 -0.892405
H -7.237571 1.005183 0.440518
H -6.589447 1.270822 -1.213287
H -5.233632 -2.219565 1.031153
H -6.910440 -2.185068 0.408813
H -6.449664 -1.134653 1.785267


