%chk=000245387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245387

0 1
O 3.643054 1.079155 -0.589116
O -1.746978 -0.532603 1.504551
O 2.821580 -0.799648 -1.548047
N -3.458496 0.273123 0.254499
C -1.109244 0.885807 -0.337675
C 0.260521 0.201185 -0.289647
C -2.096437 0.145050 0.547836
C 1.335146 1.064271 -0.958205
C -3.991912 1.103992 -0.850959
C -4.451758 -0.430699 1.114219
C -4.206288 2.555336 -0.420265
C -4.948839 -1.717597 0.458449
C 2.623296 0.297023 -1.083654
C 5.000153 0.536664 -0.601032
C 5.173363 -0.402811 0.589633
C 6.632437 -0.808349 0.758985
H -1.034104 1.932307 0.025830
H -1.467982 0.950668 -1.385511
H 0.534902 -0.010678 0.768495
H 0.206164 -0.793938 -0.780990
H 1.497943 2.003564 -0.385365
H 1.015841 1.377976 -1.975201
H -3.293951 1.059098 -1.720254
H -4.953433 0.664172 -1.202459
H -3.963622 -0.670075 2.092726
H -5.298085 0.256261 1.328450
H -4.615026 3.154755 -1.241453
H -3.273001 3.029181 -0.095028
H -4.907077 2.628049 0.421028
H -5.657520 -2.239460 1.111733
H -4.116760 -2.408689 0.264075
H -5.448997 -1.533561 -0.497575
H 5.177723 0.035368 -1.567889
H 5.601318 1.459310 -0.520579
H 4.537194 -1.302349 0.446859
H 4.796436 0.086939 1.510019
H 7.015724 -1.325759 -0.128934
H 7.279040 0.056590 0.946314
H 6.751673 -1.493429 1.607735


%chk=000245387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245387

0 1
O 3.662376 0.975224 -0.799806
O -1.983990 -1.229615 0.992652
O 2.898748 -1.206322 -1.134021
N -3.566768 0.259605 0.175679
C -1.186030 0.485607 -0.577004
C 0.215917 -0.100223 -0.321912
C -2.265055 -0.228853 0.257206
C 1.295888 0.676081 -1.112239
C -3.978451 1.419351 -0.644034
C -4.621598 -0.424176 0.965321
C -4.021082 2.745461 0.150782
C -5.280860 -1.583979 0.188649
C 2.662521 0.018338 -1.017767
C 5.063547 0.461963 -0.699777
C 5.394045 0.044688 0.740090
C 6.866124 -0.407505 0.865447
H -1.193984 1.571346 -0.350570
H -1.433892 0.391725 -1.655183
H 0.436873 -0.070088 0.760036
H 0.237570 -1.165387 -0.607866
H 1.376226 1.723796 -0.774876
H 1.019241 0.696898 -2.186978
H -3.300357 1.521173 -1.507862
H -4.982081 1.203112 -1.058585
H -4.150892 -0.816380 1.882598
H -5.377138 0.330121 1.255555
H -4.371060 3.572656 -0.494179
H -3.020405 3.007325 0.538116
H -4.708353 2.669309 1.012313
H -6.074996 -2.052861 0.798604
H -4.527362 -2.353710 -0.048756
H -5.737190 -1.233139 -0.755652
H 5.181004 -0.390208 -1.393858
H 5.681956 1.313383 -1.030115
H 4.719892 -0.778632 1.039103
H 5.198738 0.896700 1.418328
H 7.075097 -1.275332 0.212580
H 7.563790 0.404525 0.585953
H 7.095987 -0.705778 1.903626


