%chk=000188422.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188422

0 1
O 3.010608 0.668688 -1.490305
O -1.395514 2.220431 -0.515394
O -2.876708 -0.011352 0.487853
N 3.582907 -0.934440 1.789842
C 2.739461 -0.276755 -0.433068
C 1.246598 -0.229752 -0.201828
C 3.531538 0.189200 0.813572
C 0.531530 0.946284 -0.462088
C 0.587490 -1.361519 0.287470
C -0.847957 0.991498 -0.226925
C -1.514496 -0.160116 0.276647
C -0.791367 -1.327047 0.528530
C -2.832450 2.370892 -0.401872
C -3.617694 -1.186434 0.895146
H 3.072014 -1.288299 -0.761042
H 3.082501 1.124054 1.212884
H 4.568774 0.448724 0.508643
H 1.041150 1.824732 -0.868199
H 1.140682 -2.279557 0.481575
H -1.284551 -2.216828 0.910109
H 3.867359 0.467584 -1.910945
H 2.660953 -1.094206 2.190309
H 4.202605 -0.700630 2.560188
H -3.143915 2.215638 0.636902
H -3.339671 1.670577 -1.072861
H -2.974686 3.410475 -0.717331
H -3.277501 -1.529160 1.876433
H -3.537357 -1.971437 0.137743
H -4.641501 -0.795245 0.949212


%chk=000188422-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188422

0 1
O 2.966646 0.740739 -1.589837
O -1.482163 2.292893 0.046180
O -2.899300 -0.052913 0.781703
N 3.365036 -0.861308 1.809053
C 2.721651 -0.243496 -0.515992
C 1.230338 -0.232735 -0.228618
C 3.557944 0.134302 0.742264
C 0.503254 0.981799 -0.271147
C 0.553990 -1.419814 0.130514
C -0.867839 1.026600 0.046196
C -1.540363 -0.175771 0.434346
C -0.820810 -1.392713 0.461795
C -2.714336 2.451874 -0.753248
C -3.588740 -1.261905 1.236789
H 3.033990 -1.260854 -0.830719
H 3.291553 1.181220 1.020256
H 4.631643 0.128556 0.463400
H 0.994946 1.907552 -0.582282
H 1.097099 -2.371049 0.151534
H -1.321259 -2.324388 0.742915
H 3.940468 0.779402 -1.769823
H 2.414786 -0.877873 2.191574
H 4.082110 -0.854684 2.538254
H -3.521310 1.805295 -0.371047
H -2.514211 2.221010 -1.817822
H -2.985438 3.513562 -0.647290
H -3.104513 -1.683841 2.138794
H -3.624680 -2.031252 0.440891
H -4.609690 -0.934206 1.482566


