%chk=000295445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295445

0 1
O 2.123895 0.560522 -0.464892
O 4.198290 1.879772 1.161250
O 1.216146 -1.417256 0.328580
O -4.575455 2.362084 -0.834458
O -6.050501 0.914910 -0.216968
N -0.094096 0.444002 -0.280383
N -4.896135 1.267284 -0.395130
C -4.048736 -0.952102 0.470932
C -1.408933 -0.057910 -0.023815
C -3.802851 0.324792 -0.064041
C -2.492137 0.776144 -0.314023
C -2.931165 -1.772192 0.752195
C -1.634728 -1.347366 0.515206
C -5.417322 -1.458853 0.745209
C 3.437337 0.058025 -0.379026
C 4.383789 0.765167 0.387610
C 1.080242 -0.292679 -0.084172
C 3.803470 -1.069725 -1.125964
C 5.730045 0.335798 0.370487
C 5.132927 -1.483368 -1.126289
C 6.090597 -0.777347 -0.379758
C 2.849115 2.380168 1.337654
H -2.350003 1.779316 -0.733555
H -3.098942 -2.768957 1.168170
H -0.785626 -2.007538 0.743275
H -5.433681 -2.471131 1.167457
H -5.963470 -0.798673 1.443865
H -6.036655 -1.470874 -0.170758
H -0.014888 1.382107 -0.686202
H 3.043046 -1.612248 -1.688131
H 6.461520 0.890242 0.957708
H 5.430595 -2.357006 -1.703070
H 7.129868 -1.108782 -0.386277
H 2.240295 1.638127 1.860862
H 2.415716 2.646958 0.367875
H 3.022430 3.267690 1.959479


%chk=000295445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295445

0 1
O 2.123931 0.569033 -0.547750
O 4.173283 1.965121 1.078271
O 1.262706 -1.314313 0.614488
O -4.514631 2.217625 -1.465479
O -6.123558 0.920465 -0.521167
N -0.108893 0.338275 -0.394495
N -4.885943 1.192145 -0.768851
C -4.140474 -0.874235 0.527933
C -1.419346 -0.098782 -0.070922
C -3.828557 0.292285 -0.232486
C -2.502594 0.677923 -0.530018
C -3.016464 -1.625172 0.966288
C -1.684104 -1.270435 0.689534
C -5.530318 -1.356468 0.889317
C 3.478929 0.104652 -0.471308
C 4.429912 0.842814 0.282893
C 1.086920 -0.263470 -0.038010
C 3.868708 -1.010112 -1.241536
C 5.792827 0.456925 0.202057
C 5.223002 -1.395078 -1.295215
C 6.187790 -0.645661 -0.578688
C 2.879295 2.091316 1.774123
H -2.353534 1.587533 -1.120250
H -3.202401 -2.531473 1.552760
H -0.855246 -1.883286 1.049903
H -5.461313 -2.289871 1.473122
H -6.083519 -0.605827 1.479827
H -6.147227 -1.540122 -0.007282
H -0.015504 1.186028 -0.959297
H 3.105539 -1.560069 -1.801782
H 6.517360 1.041890 0.776668
H 5.521828 -2.260429 -1.894633
H 7.245408 -0.926430 -0.620139
H 2.579631 1.130500 2.233023
H 2.091355 2.445943 1.089023
H 3.059201 2.839858 2.560979


