%chk=000230209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230209

0 1
O 2.994931 -1.894483 -0.743615
O 2.829387 2.727706 -0.214044
N 3.606692 1.577245 -0.219683
C 3.760770 -0.842470 -0.134106
C 2.933416 0.468602 -0.170324
C 1.457254 0.333904 -0.106437
C 5.008786 -0.779494 -1.006814
C 4.050605 -1.192721 1.326016
C -1.329479 0.082217 0.013141
C 0.775126 0.661895 1.074354
C 0.745896 -0.114578 -1.229062
C -0.613451 0.534338 1.133449
C -0.642615 -0.240742 -1.168200
C -2.802001 -0.050879 0.077122
C -3.410863 -1.286351 -0.194700
C -3.595279 1.058798 0.409429
C -4.801279 -1.408289 -0.130997
C -4.985335 0.930761 0.467593
C -5.590155 -0.301505 0.199115
H 4.742805 -0.582579 -2.054611
H 5.545244 -1.736455 -0.989634
H 5.694397 0.011963 -0.681003
H 3.144071 -1.198755 1.940848
H 4.747252 -0.475385 1.777682
H 4.507818 -2.187632 1.401904
H 1.328313 1.027252 1.938990
H 1.284762 -0.369071 -2.143896
H -1.144681 0.785638 2.050798
H -1.196767 -0.581988 -2.042223
H 2.198424 -2.119247 -0.220858
H -2.798083 -2.149427 -0.449610
H -3.125573 2.019957 0.613552
H -5.271093 -2.368186 -0.339467
H -5.598705 1.793715 0.722012
H -6.672956 -0.398802 0.246376
H 3.524367 3.464550 -0.286896


%chk=000230209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230209

0 1
O 3.216966 -1.960870 -0.940635
O 2.790295 2.731434 -0.391482
N 3.667936 1.549598 -0.361389
C 3.847991 -0.860628 -0.171437
C 2.984441 0.427783 -0.283501
C 1.494015 0.319600 -0.201374
C 5.240486 -0.704098 -0.799451
C 3.932285 -1.265118 1.322676
C -1.362593 0.089211 -0.006767
C 0.789485 0.894581 0.889769
C 0.748927 -0.354622 -1.206388
C -0.608785 0.770873 0.989139
C -0.653923 -0.459915 -1.109906
C -2.844323 -0.038708 0.099620
C -3.516977 -1.185088 -0.407887
C -3.626292 0.979566 0.712680
C -4.918837 -1.309690 -0.306734
C -5.028137 0.856093 0.815646
C -5.682903 -0.289691 0.306602
H 5.147142 -0.492162 -1.877190
H 5.799779 -1.646626 -0.671960
H 5.792869 0.123933 -0.328961
H 2.923832 -1.381731 1.763256
H 4.474068 -0.499689 1.905526
H 4.467903 -2.226963 1.410524
H 1.345407 1.437257 1.660992
H 1.270270 -0.761052 -2.078140
H -1.121605 1.189141 1.862308
H -1.207416 -0.948071 -1.919765
H 2.359797 -2.206515 -0.503368
H -2.935779 -1.997948 -0.858085
H -3.137858 1.888444 1.082168
H -5.413863 -2.205803 -0.697598
H -5.610562 1.657620 1.283815
H -6.771367 -0.385807 0.386009
H 3.449324 3.465165 -0.502510


