%chk=000215440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215440

0 1
O -0.459575 -0.022373 -1.746170
N 2.635486 -0.837632 0.961960
C 4.544278 -1.276324 -0.504430
C 4.508216 -0.771922 -1.938528
C 5.835584 -0.911576 -1.219723
C 4.032807 -0.393829 0.632811
C 4.918145 -0.567737 1.875185
C 1.624642 -0.293106 0.006237
C 0.233146 -0.884488 0.335986
C -0.873098 -0.031849 -0.362371
C 0.159877 -2.349581 -0.094091
C -0.946221 1.410981 0.143774
C -2.248480 -0.685253 -0.243860
C -0.615568 1.737480 1.466448
C -3.014002 -0.542305 0.921189
C -1.377330 2.426828 -0.722397
C -2.744175 -1.457542 -1.304512
C -0.708809 3.058889 1.912634
C -4.267323 -1.154464 1.017262
C -1.469242 3.747566 -0.276819
C -3.997857 -2.065879 -1.207281
C -1.134850 4.067059 1.042907
C -4.763161 -1.914169 -0.046499
H 4.327390 -2.339043 -0.329662
H 4.120411 0.219552 -2.157462
H 4.253218 -1.462999 -2.738166
H 6.523765 -1.700660 -1.510956
H 6.381641 -0.017603 -0.931195
H 4.063658 0.683200 0.317616
H 2.394477 -0.556709 1.917536
H 4.639214 0.120340 2.678257
H 4.851602 -1.589723 2.271438
H 5.971160 -0.386018 1.631206
H 1.908974 -0.592937 -1.029511
H 1.585000 0.817480 0.003745
H 0.051230 -0.829200 1.438608
H 0.171806 -2.441303 -1.187854
H -0.744832 -2.842276 0.275078
H 1.029618 -2.902125 0.289372
H -1.066575 0.522993 -2.291180
H -0.280064 0.960815 2.154699
H -2.641424 0.049607 1.756140
H -1.640309 2.185144 -1.752911
H -2.136280 -1.593858 -2.201191
H -0.448399 3.302401 2.941519
H -4.858058 -1.037461 1.924116
H -1.803384 4.528202 -0.958567
H -4.376665 -2.662537 -2.035219
H -1.206784 5.095552 1.391081
H -5.739682 -2.388009 0.029351


%chk=000215440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215440

0 1
O -0.425447 -0.012939 -1.851007
N 2.635074 -0.895809 0.958496
C 4.617136 -1.244835 -0.492544
C 4.583101 -0.571147 -1.873185
C 5.919042 -0.743105 -1.133186
C 4.062580 -0.541015 0.747957
C 4.859362 -0.944210 2.006642
C 1.672551 -0.371978 -0.038323
C 0.241962 -0.881974 0.287760
C -0.850792 -0.014384 -0.423411
C 0.136485 -2.382961 -0.067400
C -0.936674 1.450367 0.079683
C -2.246730 -0.669643 -0.288661
C -0.238264 1.944713 1.208200
C -2.980314 -0.547266 0.919227
C -1.795908 2.344681 -0.615306
C -2.800187 -1.425939 -1.349706
C -0.371667 3.292869 1.613841
C -4.238906 -1.170285 1.064162
C -1.926053 3.692658 -0.221952
C -4.065340 -2.041596 -1.210312
C -1.208294 4.175963 0.897105
C -4.789482 -1.918557 -0.002935
H 4.458791 -2.330211 -0.473271
H 4.164332 0.438742 -1.935021
H 4.389958 -1.192777 -2.752417
H 6.633290 -1.480653 -1.510352
H 6.383929 0.155019 -0.711316
H 4.190007 0.563562 0.588182
H 2.341518 -0.661345 1.918960
H 4.491096 -0.412533 2.905908
H 4.761659 -2.030499 2.184731
H 5.929331 -0.704377 1.882025
H 1.955643 -0.746748 -1.034966
H 1.691572 0.741143 -0.106278
H 0.066142 -0.783393 1.381363
H 0.126156 -2.518023 -1.163351
H -0.773897 -2.848224 0.347450
H 1.020575 -2.901767 0.342169
H -0.920028 0.698954 -2.331525
H 0.414437 1.283490 1.786312
H -2.573073 0.049894 1.743798
H -2.406577 1.975868 -1.451102
H -2.224846 -1.534981 -2.274563
H 0.179822 3.651347 2.490471
H -4.793540 -1.065467 2.003724
H -2.596490 4.359923 -0.775112
H -4.481375 -2.622437 -2.041703
H -1.309278 5.220898 1.210391
H -5.769190 -2.397416 0.105948


