%chk=000246636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246636

0 1
O 2.358449 1.604889 -0.552731
O -2.661789 -0.621054 -1.508014
O 3.060062 0.314792 -2.287182
O -1.897929 -1.890109 0.205107
O 8.031414 -1.922764 2.116901
O 7.088033 -0.814821 3.718544
O -8.076338 -0.479693 3.238678
O -8.546048 0.862321 1.606630
N 7.167318 -1.185563 2.559723
N -7.820347 0.069286 2.181259
C 1.212940 2.211708 -1.290045
C 1.737290 2.927971 -2.525277
C 0.656574 3.149832 -0.221903
C 4.197167 0.211022 -0.152911
C 3.173012 0.674843 -1.138803
C 0.274643 1.148429 -1.621003
C 5.212165 -0.640985 -0.615493
C 4.146215 0.605209 1.191232
C 6.129216 -0.699011 1.612028
C 6.187464 -1.101158 0.270187
C 5.118009 0.148976 2.084020
C -4.089306 -0.851577 0.345750
C -0.492500 0.259566 -1.896476
C -1.401163 -0.807199 -2.229685
C -4.427845 -1.455130 1.567214
C -4.962918 0.050431 -0.278066
C -6.516275 -0.253514 1.539892
C -5.649880 -1.156416 2.171597
C -6.187181 0.354056 0.320549
C -2.771641 -1.198462 -0.258930
H 2.151129 2.214013 -3.258425
H 0.944265 3.490830 -3.031904
H 2.539730 3.631842 -2.273103
H 1.399101 3.903615 0.071029
H 0.381161 2.600016 0.689109
H -0.237306 3.674177 -0.580800
H 5.230530 -0.942051 -1.668887
H 3.344347 1.268474 1.532866
H 6.989031 -1.767363 -0.069127
H 5.097618 0.443941 3.139346
H -0.977664 -1.808901 -1.986533
H -1.744446 -0.769526 -3.287124
H -3.730417 -2.156031 2.039935
H -4.681567 0.511125 -1.231307
H -5.935182 -1.616142 3.125328
H -6.886339 1.055707 -0.149295


%chk=000246636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246636

0 1
O 2.466788 1.702930 -0.513957
O -2.779867 -0.470617 -1.564927
O 3.063545 0.171705 -2.187809
O -2.056981 -1.939764 0.105530
O 8.082328 -2.178414 2.165421
O 7.423404 -0.660585 3.735543
O -8.199842 -0.752014 3.372068
O -8.772019 0.728642 1.733707
N 7.323049 -1.219581 2.576727
N -7.961724 -0.117615 2.274284
C 1.314424 2.287740 -1.337771
C 1.891870 2.992316 -2.585304
C 0.681568 3.289087 -0.348771
C 4.275890 0.203742 -0.075375
C 3.228215 0.662951 -1.045790
C 0.353824 1.223227 -1.679514
C 5.135788 -0.848821 -0.484080
C 4.421225 0.785165 1.210989
C 6.263901 -0.725988 1.654959
C 6.138322 -1.322529 0.380960
C 5.420980 0.321404 2.086555
C -4.240115 -0.866671 0.292976
C -0.504817 0.375790 -1.932514
C -1.470647 -0.665229 -2.279002
C -4.543181 -1.538175 1.506141
C -5.164998 0.052951 -0.266472
C -6.667248 -0.378720 1.586241
C -5.763457 -1.298080 2.162846
C -6.389395 0.302694 0.381174
C -2.925116 -1.163004 -0.356021
H 2.341843 2.266407 -3.278227
H 1.081230 3.528303 -3.109118
H 2.654197 3.727019 -2.272637
H 1.428623 4.049591 -0.065541
H 0.333766 2.770735 0.559215
H -0.178742 3.790362 -0.823390
H 4.999588 -1.279830 -1.480662
H 3.749104 1.592149 1.511942
H 6.815044 -2.131698 0.095629
H 5.559050 0.747283 3.083474
H -1.075432 -1.664665 -2.020293
H -1.744547 -0.626688 -3.345754
H -3.810685 -2.240543 1.915537
H -4.915269 0.561758 -1.200524
H -6.026753 -1.799257 3.097529
H -7.123930 1.004141 -0.022094


