%chk=000207445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207445

0 1
O 0.520848 0.355667 0.117622
O 5.776632 -0.400286 -0.647923
O 1.839889 -1.786986 1.187953
N 1.902298 0.432338 0.400840
N 3.807146 -1.086595 0.248684
C 2.495399 1.206656 -0.736748
C 4.013146 1.251976 -0.570922
C -1.664050 0.458955 0.874093
C -0.250307 0.465625 1.376586
C -3.525345 -0.753375 -0.123500
C 4.637821 -0.106415 -0.362114
C -2.204589 -0.719606 0.340674
C -4.318299 0.414772 -0.049895
C 2.437310 -0.903701 0.616417
C -2.446270 1.618627 0.936244
C -3.766095 1.589300 0.480859
C -4.078332 -2.022242 -0.688121
C -5.733500 0.412097 -0.530672
H 2.059148 2.232712 -0.694579
H 2.206262 0.780562 -1.724493
H 4.291834 1.896202 0.296904
H 4.481853 1.739910 -1.454589
H 0.040172 1.391757 1.897201
H -0.009498 -0.414400 2.004416
H -1.581661 -1.613871 0.284056
H -2.032822 2.541501 1.337687
H 4.224561 -2.004777 0.464337
H -4.371055 2.492910 0.537904
H -4.401202 -1.887945 -1.730298
H -3.346405 -2.841004 -0.682005
H -4.950922 -2.367105 -0.115293
H -6.224200 1.386322 -0.409779
H -5.791041 0.152170 -1.597559
H -6.338924 -0.324048 0.017711


%chk=000207445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207445

0 1
O 0.529898 0.612680 -0.258036
O 5.932657 -0.622150 -0.186985
O 1.494146 -1.885686 0.482823
N 1.941814 0.386039 0.015600
N 3.695939 -1.200837 0.071830
C 2.817653 1.318263 -0.723827
C 4.255078 1.186475 -0.185577
C -1.690069 0.646202 0.692635
C -0.231311 0.764162 1.045654
C -3.570775 -0.768391 -0.062711
C 4.727709 -0.264997 -0.119752
C -2.209107 -0.606554 0.277411
C -4.448546 0.359338 0.020824
C 2.293311 -0.956737 0.192269
C -2.559016 1.758316 0.765964
C -3.924128 1.607333 0.436221
C -4.091160 -2.123402 -0.507945
C -5.918974 0.224123 -0.329829
H 2.433176 2.337841 -0.562017
H 2.778495 1.105454 -1.812060
H 4.318687 1.603797 0.837914
H 4.961922 1.747756 -0.817501
H 0.020289 1.746162 1.488191
H 0.100688 -0.053581 1.708455
H -1.525039 -1.461568 0.212363
H -2.174316 2.736884 1.078336
H 3.968552 -2.181532 0.197745
H -4.595433 2.472107 0.499484
H -4.519574 -2.079398 -1.528125
H -3.286113 -2.876992 -0.512658
H -4.896178 -2.490478 0.157862
H -6.445232 1.188581 -0.229889
H -6.057623 -0.132467 -1.368721
H -6.427618 -0.509042 0.325750


