%chk=000203168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203168

0 1
O 3.452747 0.313262 -0.444556
O -2.689950 1.401256 2.422826
O 0.299371 -1.397609 -2.667978
O 2.860321 -0.860083 -2.281454
N -5.617820 0.561844 0.560638
N -2.871050 0.111805 0.510483
C 7.114340 0.980954 -0.082437
C -4.894042 0.641428 1.863129
C 5.608851 0.974007 0.204149
C -5.840498 1.936394 -0.006602
C -6.900509 -0.206664 0.685905
C 7.883794 1.741674 1.006760
C 4.856516 0.216785 -0.882805
C -3.385994 0.785002 1.641468
C -6.106720 1.837839 -1.507838
C -6.610389 -1.696655 0.861316
C 9.385038 1.753916 0.729678
C -1.513928 0.050514 0.106277
C 1.160975 -0.151704 -0.764418
C -1.233813 -0.631981 -1.088291
C -0.468086 0.634484 0.866893
C 0.100861 -0.728390 -1.513630
C 2.523334 -0.280935 -1.249873
C 0.838453 0.529078 0.431235
H 7.311995 1.441535 -1.070259
H 7.493764 -0.057423 -0.151753
H -5.226011 1.476912 2.522007
H -5.056797 -0.292109 2.454900
H 5.219323 2.009973 0.276527
H 5.400556 0.515322 1.192296
H -6.668982 2.479128 0.497658
H -4.919183 2.540162 0.160503
H -7.542867 0.161955 1.514632
H -7.478408 -0.055160 -0.255491
H 7.508013 2.781528 1.077553
H 7.689787 1.282387 1.996172
H 5.116465 -0.853233 -0.943847
H 4.930165 0.678223 -1.881804
H -5.319216 1.263556 -2.014604
H -7.058270 1.340625 -1.729019
H -6.136323 2.833589 -1.965000
H -5.946946 -2.068401 0.068905
H -6.123927 -1.916893 1.818640
H -7.535892 -2.282366 0.818828
H 9.798430 0.739489 0.691936
H 9.616767 2.237730 -0.226148
H 9.926807 2.298641 1.511434
H -3.563677 -0.321658 -0.125823
H -2.008749 -1.089705 -1.697791
H -0.702756 1.167840 1.794590
H 1.653820 0.975754 1.010521
H 1.299010 -1.442422 -2.941039


%chk=000203168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203168

0 1
O 3.383538 0.489954 -0.311297
O -2.919914 1.503590 2.809259
O 0.145573 -0.877715 -2.697468
O 2.669250 -0.498217 -2.293032
N -5.654470 0.480635 0.543146
N -3.001482 0.454495 0.682644
C 7.187710 0.870727 -0.126396
C -5.085744 0.796650 1.879277
C 5.695123 0.960624 0.270298
C -5.988668 1.726648 -0.217958
C -6.775878 -0.505549 0.590656
C 8.124374 1.486328 0.938303
C 4.790048 0.361202 -0.804854
C -3.548429 0.974144 1.846335
C -6.054385 1.513328 -1.740833
C -6.300234 -1.939938 0.884109
C 9.615449 1.391412 0.550386
C -1.653453 0.374046 0.277448
C 1.028497 0.155954 -0.637937
C -1.386691 -0.198457 -0.989361
C -0.580344 0.843872 1.099703
C -0.060955 -0.312348 -1.455248
C 2.392359 0.018766 -1.151036
C 0.732849 0.727695 0.631277
H 7.349463 1.387393 -1.095426
H 7.468136 -0.190983 -0.287874
H -5.514989 1.714408 2.334901
H -5.292949 -0.031675 2.581208
H 5.413026 2.018206 0.435864
H 5.527594 0.428016 1.226193
H -6.946863 2.165809 0.149807
H -5.195810 2.465706 0.002515
H -7.544247 -0.195551 1.338998
H -7.272319 -0.492496 -0.395498
H 7.847588 2.548580 1.095387
H 7.958899 0.974874 1.908235
H 4.999006 -0.709860 -0.982734
H 4.871077 0.894264 -1.769974
H -5.093131 1.124869 -2.122133
H -6.850475 0.805691 -2.032949
H -6.262611 2.473616 -2.246737
H -5.589415 -2.278081 0.109759
H -5.799233 -2.022390 1.865687
H -7.162045 -2.632110 0.893446
H 9.925600 0.337432 0.419795
H 9.812537 1.919142 -0.401911
H 10.263350 1.840250 1.325360
H -3.759243 0.103056 0.059814
H -2.194030 -0.565631 -1.631379
H -0.805493 1.281967 2.073150
H 1.566659 1.079343 1.245932
H 1.154496 -0.880493 -2.871462


