%chk=000275781.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275781

0 1
O 1.975690 0.249578 1.382677
O 2.872424 2.855139 -0.152164
O 3.447724 -0.215312 -1.635627
O 4.225382 -2.267880 -0.037373
O -5.347601 -1.675942 -0.600119
N 0.206135 0.409001 -0.178141
N -1.699598 1.279655 1.172795
N -3.842389 0.247355 0.619279
N -4.121634 -1.305647 -1.191153
C 1.313475 1.136130 0.467378
C 2.371416 1.590460 -0.580076
C 3.531022 0.569937 -0.446165
C 3.232947 -0.236030 0.844933
C 3.070013 -1.749069 0.638014
C -1.136381 0.464867 0.219340
C 0.311090 -0.580133 -1.202267
C -1.875588 -0.478804 -0.582067
C -0.931774 -1.113785 -1.463069
C -3.268802 -0.543394 -0.333309
C -3.035532 1.119737 1.318867
H 0.916091 1.959047 1.118371
H 1.986795 1.638388 -1.621057
H 4.520959 1.073492 -0.412385
H 3.966228 -0.004513 1.648709
H 2.236013 -1.986960 -0.053699
H 2.905182 -2.274748 1.593862
H 1.271280 -0.792483 -1.660226
H 2.609058 3.561622 -0.780986
H 4.035794 -1.021499 -1.561703
H -1.173947 -1.859430 -2.195453
H 4.987735 -2.328898 0.574170
H -3.543666 1.743236 2.073862
H -3.727507 -2.209115 -1.485609
H -5.840533 -0.799703 -0.431207


%chk=000275781-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275781

0 1
O 1.930620 -0.109565 1.304411
O 2.801014 2.698640 0.054350
O 3.270286 -0.467779 -1.633314
O 4.905266 -1.953962 -0.002815
O -5.751635 -0.984716 -0.691339
N 0.100737 0.156288 -0.264127
N -1.711171 1.218868 1.014617
N -3.935200 0.417393 0.432356
N -4.405766 -1.134405 -1.194551
C 1.198541 0.829608 0.427804
C 2.262845 1.459868 -0.519301
C 3.445037 0.471425 -0.523931
C 3.348849 -0.211685 0.869986
C 3.708828 -1.711533 0.840884
C -1.243288 0.340069 0.074183
C 0.178400 -0.814302 -1.282991
C -2.022189 -0.529864 -0.751015
C -1.106839 -1.251236 -1.604166
C -3.428506 -0.445715 -0.517254
C -3.062222 1.200753 1.137726
H 0.716167 1.583192 1.076970
H 1.864968 1.617041 -1.538987
H 4.389024 1.035946 -0.633743
H 3.968407 0.348843 1.597798
H 2.894588 -2.267349 0.353185
H 3.856380 -2.111350 1.860158
H 1.150605 -1.084969 -1.694946
H 2.082557 3.377712 0.112145
H 4.011397 -1.133272 -1.548246
H -1.342427 -1.987187 -2.370960
H 5.728523 -1.707922 0.485927
H -3.504548 1.875985 1.874739
H -4.277282 -2.013712 -1.691486
H -5.574467 -0.256809 0.014339


