%chk=000215493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215493

0 1
O 0.974667 1.166141 -1.520850
O -0.000586 3.512994 0.417368
O 2.357705 2.909496 1.102946
O 2.126939 -1.208140 -0.963448
N -1.047554 0.250963 -0.723011
N 3.856463 -0.292637 0.215093
N -1.763295 -1.917518 -0.974883
N -3.036273 1.166347 0.508759
N -4.773542 -0.526026 0.858401
N -4.562182 -2.768452 0.132562
C 0.092690 2.093006 0.532211
C -0.251471 1.490712 -0.860895
C 1.596641 1.773143 0.753010
C 2.091420 1.200525 -0.602135
C 2.660429 -0.222941 -0.486541
C -2.315965 0.184535 -0.130749
C -0.762725 -1.071364 -1.220492
C -2.750357 -1.173792 -0.298310
C 4.572789 -1.591186 0.409348
C -4.034110 -1.509140 0.224973
C 4.685518 -1.883174 1.908293
C 5.949378 -1.511008 -0.256391
C -4.244051 0.731886 0.964715
H -0.558191 1.723917 1.352232
H -0.767138 2.212578 -1.544430
H 1.758063 1.070610 1.602376
H 2.820386 1.883509 -1.100620
H -0.851508 3.827192 0.806693
H 1.960462 3.739984 0.713325
H 0.195053 -1.285908 -1.706352
H 4.293676 0.535219 0.611121
H 3.960810 -2.397568 -0.086890
H 5.178469 -2.847743 2.080493
H 5.266448 -1.123788 2.442757
H 3.697241 -1.936498 2.381826
H 5.863640 -1.284979 -1.326976
H 6.479944 -2.466945 -0.169698
H 6.589969 -0.743913 0.191606
H -4.875848 1.473592 1.482849
H -5.477951 -2.973173 0.498913
H -4.050056 -3.499460 -0.338299


%chk=000215493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215493

0 1
O 0.879666 0.986883 -1.661708
O 0.432111 3.485773 0.127852
O 2.384798 2.262799 1.413560
O 2.357038 -1.365696 -1.252516
N -1.133968 0.162245 -0.645294
N 3.996773 -0.209475 -0.056298
N -1.865999 -2.009652 -0.599912
N -3.109561 1.289687 0.361050
N -4.884105 -0.318716 0.928880
N -4.685410 -2.644730 0.553889
C 0.114054 2.072533 0.358973
C -0.328294 1.368509 -0.949079
C 1.479677 1.403283 0.673096
C 2.034068 1.042731 -0.746151
C 2.799513 -0.297080 -0.732691
C -2.414388 0.198723 -0.084377
C -0.854008 -1.188955 -0.945590
C -2.847682 -1.153306 -0.064296
C 4.870278 -1.387587 0.173025
C -4.146414 -1.389683 0.473939
C 4.375704 -2.216234 1.382332
C 6.327592 -0.916397 0.341440
C -4.338090 0.932260 0.849574
H -0.635941 1.957170 1.159230
H -0.922849 2.035875 -1.597352
H 1.333682 0.497875 1.284253
H 2.697846 1.860110 -1.086617
H -0.391101 4.030764 0.161885
H 2.151987 3.197378 1.148600
H 0.100385 -1.481001 -1.385753
H 4.221060 0.666374 0.429672
H 4.780232 -2.012093 -0.734936
H 4.998102 -3.120990 1.507359
H 4.432074 -1.625524 2.315638
H 3.331545 -2.536747 1.225671
H 6.669876 -0.349846 -0.542675
H 6.994002 -1.786551 0.473490
H 6.438223 -0.273109 1.236088
H -4.963899 1.747235 1.225746
H -5.618848 -2.758787 0.943186
H -4.153729 -3.445050 0.217717


