%chk=000298636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298636

0 1
O 0.317760 -3.751447 -1.814588
O 0.677128 1.971138 -2.059286
O 2.847914 -1.458094 0.169971
O -0.485833 1.016813 1.119576
O -2.707489 2.327946 -0.029239
O -3.874363 0.868713 1.253178
N 1.563599 0.027758 -1.120147
N -1.230882 -3.790347 -0.138655
C 0.680341 -0.942500 -1.803624
C -0.288690 -1.628597 -0.877809
C -1.106486 -1.012380 0.026170
C -0.322274 -3.085247 -1.017229
C 2.564143 2.031693 -0.470029
C 3.216848 0.975210 0.226031
C 1.484334 1.447546 -1.329638
C 2.592895 -0.336052 -0.167212
C -2.061897 -3.124196 0.763087
C -2.017736 -1.748140 0.831620
C -1.124723 0.479572 0.251433
C 2.938633 3.345601 -0.290685
C 4.247140 1.229443 1.104356
C -1.237794 -5.272488 -0.215946
C -2.982363 -3.921593 1.624614
C -2.050308 1.232298 -0.702339
C 3.999246 3.609217 0.609224
C 4.636474 2.578214 1.289147
C -3.622103 2.014424 0.961933
C -4.162931 3.280991 1.519617
H 0.122324 -0.406214 -2.610763
H 1.327752 -1.710864 -2.308957
H -2.685714 -1.202035 1.505163
H 2.436534 4.157520 -0.817863
H 4.747151 0.423848 1.643424
H -0.503218 -5.610060 -0.981516
H -2.227829 -5.650418 -0.515581
H -0.944533 -5.721802 0.746221
H -2.431436 -4.590044 2.304585
H -3.672772 -4.542299 1.033533
H -3.608730 -3.273889 2.260451
H -1.457220 1.758683 -1.489946
H -2.813528 0.580628 -1.163808
H 4.311692 4.642481 0.767102
H 5.449746 2.801416 1.981387
H -5.264066 3.280161 1.505835
H -3.813990 4.168936 0.965851
H -3.848343 3.405758 2.569649


%chk=000298636-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298636

0 1
O 0.455258 -3.928880 -1.803403
O 0.709035 1.745113 -2.287558
O 2.889493 -1.350893 0.507875
O -0.419025 0.934134 1.073619
O -2.558476 2.388305 -0.047410
O -3.605060 1.076534 1.565477
N 1.621589 -0.058094 -1.037726
N -1.284715 -3.925691 -0.216332
C 0.895228 -1.151997 -1.692576
C -0.195408 -1.803119 -0.849598
C -1.096948 -1.137627 -0.020401
C -0.286921 -3.255482 -1.012053
C 2.451071 2.056114 -0.530029
C 3.092810 1.126929 0.324428
C 1.495508 1.309988 -1.404022
C 2.577990 -0.244236 0.010074
C -2.175086 -3.246651 0.612603
C -2.102662 -1.861111 0.704240
C -1.118469 0.362375 0.202855
C 2.734051 3.427917 -0.466428
C 4.041837 1.539148 1.270355
C -1.333465 -5.401136 -0.339942
C -3.195065 -4.044824 1.389793
C -2.116126 1.132985 -0.681871
C 3.694417 3.855559 0.486868
C 4.338053 2.925488 1.342177
C -3.295048 2.211461 1.133503
C -3.617621 3.540127 1.769156
H 0.472362 -0.730440 -2.624761
H 1.604059 -1.948913 -1.978639
H -2.803526 -1.320120 1.343745
H 2.227473 4.136270 -1.129068
H 4.529766 0.812885 1.927722
H -0.499316 -5.694728 -0.994642
H -2.283710 -5.727819 -0.797458
H -1.220564 -5.877465 0.648255
H -2.713838 -4.727173 2.115488
H -3.828557 -4.663887 0.727546
H -3.850239 -3.360837 1.950656
H -1.607128 1.447315 -1.611181
H -2.984384 0.493085 -0.917711
H 3.942725 4.919347 0.566485
H 5.073525 3.285177 2.069841
H -4.487998 3.436612 2.433769
H -3.802173 4.308973 1.002796
H -2.750321 3.866583 2.371782


