%chk=000195687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195687

0 1
O -3.961852 -0.058490 -1.185715
O -1.897841 -2.806708 -1.469136
O 2.821390 -1.637592 2.656735
O -1.222498 2.642759 1.570500
O -2.368863 3.668020 -0.082733
N -0.159181 -2.215575 -0.119788
N 3.648969 0.156311 1.455986
C 0.450624 -1.151751 0.730202
C 1.966642 -1.166255 0.356638
C -0.265289 0.176267 0.490962
C 2.213711 -2.551658 -0.282733
C -1.782753 0.094372 0.776224
C -2.386205 -1.275847 0.355316
C 0.864406 -3.001188 -0.866848
C -1.483747 -2.124043 -0.545804
C 2.450498 -0.037488 -0.526382
C 2.820930 -0.981859 1.644563
C -3.791426 -1.191663 -0.262152
C -2.448799 1.266875 0.103208
C 3.445000 0.721290 0.164931
C 2.107831 0.303117 -1.821867
C -3.400450 1.115947 -0.851022
C -4.887161 -1.068879 0.783834
C 4.072308 1.816409 -0.413950
C -2.046650 2.628501 0.455961
C 2.737921 1.412608 -2.419057
C 3.695492 2.152919 -1.726778
C -0.781511 3.951483 2.020228
H 0.337784 -1.467500 1.804503
H -0.109502 0.520490 -0.552954
H 0.181293 0.973388 1.125132
H 2.565922 -3.272067 0.483091
H 2.999140 -2.508247 -1.057096
H -1.940494 0.198638 1.882557
H -2.482636 -1.880698 1.303224
H 0.790043 -2.814437 -1.959715
H 0.675001 -4.084583 -0.707543
H -3.975110 -2.036734 -0.979247
H 4.311857 0.507920 2.131213
H 1.363797 -0.271093 -2.374229
H -3.823163 1.909939 -1.475930
H -5.010583 -1.997861 1.353181
H -4.692138 -0.259125 1.498803
H -5.854617 -0.848120 0.309385
H 4.824410 2.393273 0.114528
H 2.468010 1.691953 -3.436506
H 4.168510 3.010282 -2.207599
H -0.071589 4.357941 1.293657
H -0.307829 3.727588 2.980915
H -1.641398 4.620871 2.132403


%chk=000195687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195687

0 1
O -3.969708 -0.076336 -1.216238
O -1.902896 -2.820600 -1.595182
O 2.705528 -1.543676 2.743168
O -1.377753 2.741975 1.698256
O -2.645902 3.730012 0.006276
N -0.105642 -2.039106 -0.359274
N 3.703862 0.130128 1.395112
C 0.454321 -1.122863 0.666310
C 1.992949 -1.156591 0.361698
C -0.250567 0.234138 0.568928
C 2.177008 -2.624190 -0.159851
C -1.791493 0.106309 0.818293
C -2.351075 -1.279959 0.304494
C 0.912718 -2.895434 -1.007103
C -1.442111 -2.080007 -0.668972
C 2.532841 -0.093593 -0.587788
C 2.814370 -0.916778 1.657693
C -3.790582 -1.216565 -0.245446
C -2.507484 1.289916 0.174071
C 3.559816 0.634144 0.075895
C 2.207451 0.228651 -1.916212
C -3.445484 1.127149 -0.815661
C -4.868011 -1.087946 0.841632
C 4.273221 1.670483 -0.550173
C -2.211169 2.683292 0.557223
C 2.914115 1.273256 -2.568026
C 3.933276 1.982384 -1.890700
C -1.077590 4.108388 2.180761
H 0.323718 -1.553979 1.683885
H -0.078518 0.649378 -0.439878
H 0.167046 0.947580 1.297790
H 2.211528 -3.299884 0.714432
H 3.107815 -2.744036 -0.736917
H -1.948135 0.148202 1.913131
H -2.399779 -1.937885 1.198491
H 1.042688 -2.610698 -2.068406
H 0.598715 -3.953565 -0.989019
H -3.960208 -2.098221 -0.884207
H 4.367151 0.474750 2.089237
H 1.413909 -0.307944 -2.447057
H -3.864659 1.976679 -1.363997
H -4.863283 -1.987972 1.483039
H -4.704332 -0.202781 1.481330
H -5.864970 -1.003040 0.377282
H 5.063645 2.222255 -0.030159
H 2.664692 1.534929 -3.601369
H 4.469363 2.786625 -2.406331
H -0.553604 4.686454 1.400878
H -0.438884 3.961761 3.063787
H -2.009706 4.634515 2.447966


