%chk=000267765.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267765

0 1
O 0.277360 -2.732120 0.654083
O 1.666169 -0.085640 0.343232
O -1.838637 -0.090343 -0.385572
O 0.038416 -3.894927 -1.270875
O 1.939725 1.344725 2.077618
O -2.083673 1.337613 -2.119657
O 8.604465 1.657202 -0.185705
O 8.282399 -0.193800 -1.260568
O -8.798993 1.765711 -0.103408
O -8.386639 0.363971 1.494195
N 7.907815 0.729301 -0.558674
N -8.058931 1.035382 0.531453
C 0.253914 -0.256064 0.675646
C -0.414415 -0.272719 -0.713502
C 0.039031 -1.567903 1.469181
C -0.263579 -1.588031 -1.458547
C -0.515611 -2.798848 -0.558653
C 1.000975 -1.727031 2.632650
C 2.423211 0.732385 1.155205
C -2.580407 0.754155 -1.186923
C -0.081785 -5.172907 -0.603509
C 3.838210 0.713884 0.690972
C -3.991872 0.804038 -0.714647
C 4.682984 1.757318 1.100756
C 4.314553 -0.325765 -0.120378
C -4.885082 1.629978 -1.415508
C -4.420623 0.054905 0.390512
C 6.017153 1.765548 0.691754
C 5.648984 -0.323927 -0.532042
C -6.218483 1.708710 -1.010099
C -5.752712 0.128765 0.801710
C 6.484592 0.723290 -0.121336
C -6.636809 0.955577 0.095269
H -0.089044 0.620173 1.279139
H -0.069691 0.589011 -1.336299
H -1.028514 -1.595037 1.798617
H 0.774632 -1.662337 -1.864277
H -0.928346 -1.624601 -2.344875
H -1.571662 -2.969689 -0.279566
H 2.012230 -1.965491 2.269723
H 1.063297 -0.817534 3.244324
H 0.701652 -2.559339 3.282676
H 0.404394 -5.129989 0.377273
H -1.133301 -5.457865 -0.521208
H 0.460518 -5.842200 -1.282040
H 4.293942 2.555558 1.741750
H 3.637724 -1.132560 -0.427588
H -4.531272 2.208484 -2.276768
H -3.710157 -0.583081 0.925364
H 6.696510 2.569921 0.998010
H 6.044042 -1.125972 -1.167035
H -6.933505 2.347474 -1.542731
H -6.110651 -0.447457 1.663176


%chk=000267765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267765

0 1
O 0.373325 -2.814979 0.588782
O 1.817151 -0.223947 0.437912
O -1.813264 -0.081899 -0.204470
O -0.193005 -3.908646 -1.423830
O 2.019140 1.674587 1.791893
O -2.175040 1.066327 -2.204744
O 8.834886 1.824945 -0.053544
O 8.549424 -0.117158 -1.215802
O -8.945340 1.668397 -0.314252
O -8.494709 0.546149 1.620245
N 8.109665 0.847076 -0.480299
N -8.142521 1.057965 0.489597
C 0.370321 -0.336994 0.766897
C -0.367624 -0.251224 -0.585548
C 0.110217 -1.677250 1.490127
C -0.202882 -1.518549 -1.438115
C -0.499330 -2.776307 -0.615875
C 0.975084 -1.882294 2.733869
C 2.533425 0.827013 1.024925
C -2.614928 0.601208 -1.127189
C -0.515582 -5.198311 -0.788007
C 3.970274 0.799092 0.614199
C -4.034932 0.701128 -0.669886
C 4.807801 1.854153 1.061422
C 4.498581 -0.243194 -0.192010
C -4.955595 1.365441 -1.521948
C -4.470161 0.155286 0.565736
C 6.168003 1.877589 0.705254
C 5.858739 -0.231874 -0.553444
C -6.305926 1.487232 -1.148398
C -5.818600 0.270706 0.951792
C 6.670045 0.830664 -0.098848
C -6.714013 0.935239 0.085639
H 0.084098 0.511316 1.415390
H -0.057933 0.645108 -1.150149
H -0.970269 -1.669935 1.765760
H 0.845425 -1.581326 -1.781335
H -0.853700 -1.471439 -2.327153
H -1.559798 -2.801559 -0.259614
H 2.037366 -1.965065 2.449819
H 0.858606 -1.039013 3.437946
H 0.681933 -2.813030 3.246825
H 0.111477 -5.358905 0.105733
H -1.587693 -5.239984 -0.504615
H -0.302406 -5.963622 -1.548923
H 4.374556 2.642698 1.684277
H 3.841670 -1.051740 -0.521880
H -4.592772 1.776859 -2.468797
H -3.749689 -0.350890 1.212497
H 6.838626 2.676382 1.031183
H 6.298200 -1.019035 -1.171055
H -7.038880 1.992390 -1.782181
H -6.186945 -0.136880 1.896489


