%chk=000273880.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273880

0 1
O -3.144995 -2.869718 0.569993
O 6.193295 -0.197228 -1.108914
N 0.231914 0.250599 -1.121054
N -1.422792 2.340328 -0.312848
N 3.532811 -0.216027 -0.386024
N 4.515262 0.028329 0.540783
N 6.816031 0.337770 1.040081
C -0.962507 -0.056623 -0.479784
C -1.859542 1.037526 -0.120691
C -3.143337 0.738672 0.421246
C -1.365692 -1.371859 -0.237285
C 1.355014 -0.702536 -1.200319
C -3.537408 -0.599857 0.635853
C -2.647589 -1.615428 0.304592
C -3.997170 1.851516 0.741470
C 2.322080 -0.541538 -0.032722
C -3.557630 3.130356 0.534630
C -2.239062 3.337634 0.002320
C 1.796389 -0.760920 1.348198
C -2.343405 -4.022850 0.218579
C 5.860946 0.041479 0.028853
H 0.500349 1.240002 -1.182048
H 1.881366 -0.525639 -2.175725
H 0.989202 -1.756114 -1.231818
H -0.713931 -2.198150 -0.495976
H -4.512752 -0.836528 1.047127
H -4.987918 1.646003 1.145521
H -4.177405 3.994650 0.762569
H -1.871442 4.356824 -0.158877
H 1.768765 0.179297 1.920325
H 0.762401 -1.143083 1.349879
H 2.396761 -1.487759 1.911091
H -2.155851 -4.041838 -0.858960
H -3.001128 -4.850326 0.516647
H -1.416107 -4.031321 0.797319
H 4.362096 -0.172454 1.536487
H 7.755733 0.518938 0.698174
H 6.564948 0.918575 1.825705


%chk=000273880-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273880

0 1
O -3.246157 -2.931759 0.566626
O 6.301230 0.357383 -1.244366
N 0.213388 0.360079 -0.796270
N -1.532660 2.340846 -0.322455
N 3.637231 -0.183757 -0.500145
N 4.682694 -0.160314 0.408474
N 6.916608 0.207318 1.000631
C -1.035292 -0.024738 -0.346572
C -1.981102 1.054030 -0.097529
C -3.316119 0.746513 0.361395
C -1.447167 -1.357096 -0.120709
C 1.341644 -0.510746 -1.123551
C -3.706296 -0.606076 0.572060
C -2.776315 -1.628097 0.329411
C -4.188333 1.867829 0.578988
C 2.435116 -0.493628 -0.059223
C -3.727905 3.166121 0.347633
C -2.384513 3.362487 -0.105118
C 2.076682 -0.813679 1.382187
C -2.345517 -4.055774 0.308454
C 5.989549 0.155612 -0.045178
H 0.315802 1.379236 -0.886323
H 1.805307 -0.196207 -2.075669
H 0.969479 -1.541997 -1.272266
H -0.753947 -2.183233 -0.296579
H -4.711693 -0.862744 0.917149
H -5.212498 1.688690 0.925921
H -4.376199 4.033760 0.506332
H -2.000052 4.371360 -0.292956
H 2.397646 -0.009939 2.076153
H 0.987051 -0.920882 1.496882
H 2.552117 -1.758021 1.719413
H -2.035962 -4.092880 -0.754215
H -2.934056 -4.952735 0.551817
H -1.447957 -4.016122 0.956719
H 4.531115 -0.393583 1.398396
H 7.878322 0.411103 0.741170
H 6.676457 0.142343 1.987711


