%chk=000269384.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269384

0 1
O 1.362927 -2.251516 -0.748922
O -1.623983 -1.921478 -0.985949
O 0.498739 -1.216418 1.071474
O -2.884846 -3.452728 0.108900
O 6.208177 1.248792 -2.386485
O -2.371271 3.257809 2.304548
O 5.551975 -0.799634 -2.623536
O -0.766561 2.248700 1.265798
N 5.440104 0.326753 -2.169692
N -1.909983 2.308474 1.696287
C 0.354598 -3.299905 -0.644874
C -0.800835 -2.961637 -1.580799
C 2.285817 -0.165645 -0.176477
C -3.118764 -1.078057 0.590907
C 3.373659 -0.435428 -1.015091
C -2.274675 0.017346 0.812471
C 4.283090 0.595588 -1.288121
C -2.792825 1.149569 1.456019
C 2.106715 1.116804 0.374471
C -4.456616 -1.046855 1.014566
C 1.290896 -1.211483 0.155877
C -2.582367 -2.297340 -0.063954
C 4.115788 1.881066 -0.742440
C -4.133241 1.195858 1.879217
C 3.023012 2.133139 0.086919
C -4.957852 0.093181 1.653325
H 0.029772 -3.410087 0.408936
H 0.915903 -4.195257 -0.973292
H -0.460126 -2.467033 -2.512446
H -1.424009 -3.847806 -1.806748
H 3.513459 -1.434068 -1.453611
H -1.217615 -0.017120 0.499919
H 1.241796 1.316403 1.026073
H -5.099871 -1.917333 0.847577
H 4.843703 2.668118 -0.975607
H -4.513412 2.092986 2.382647
H 2.877830 3.128646 0.513857
H -5.998907 0.117796 1.981253


%chk=000269384-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269384

0 1
O 1.457608 -2.336855 -0.763357
O -1.491159 -1.977123 -0.879375
O 0.674962 -1.332079 1.200051
O -3.281503 -3.331974 -0.223702
O 6.050934 1.558917 -2.678915
O -2.444114 3.348261 2.386487
O 5.286774 -0.541249 -3.132054
O -0.716497 2.256514 1.379847
N 5.253464 0.565928 -2.470093
N -1.948968 2.336648 1.758315
C 0.468076 -3.435388 -0.612055
C -0.775551 -3.145138 -1.451297
C 2.391557 -0.224127 -0.129125
C -3.190700 -0.999246 0.486330
C 3.353633 -0.364620 -1.156038
C -2.331736 0.091462 0.752184
C 4.231826 0.708345 -1.398462
C -2.851442 1.195249 1.453516
C 2.313865 0.980206 0.619704
C -4.539048 -0.970530 0.927817
C 1.427011 -1.316489 0.197534
C -2.697036 -2.222734 -0.214583
C 4.176377 1.914891 -0.665256
C -4.193967 1.254220 1.889544
C 3.202557 2.041897 0.347177
C -5.036489 0.155462 1.618638
H 0.214238 -3.561061 0.454481
H 0.982034 -4.331355 -0.997473
H -0.502116 -2.853731 -2.477832
H -1.449485 -4.021478 -1.463337
H 3.422638 -1.279162 -1.748410
H -1.284755 0.069081 0.447766
H 1.549040 1.073517 1.396538
H -5.175707 -1.838000 0.725918
H 4.880348 2.718187 -0.898191
H -4.547521 2.136749 2.429174
H 3.129747 2.970679 0.920436
H -6.078696 0.176328 1.951095


