%chk=000245427.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245427

0 1
O 2.310354 -0.217865 -1.067329
O -2.421274 -1.647211 -0.503246
O 1.488546 1.190948 0.501870
N -3.642692 0.146491 0.153064
C -1.195665 0.409472 -0.181670
C 0.015482 -0.386879 -0.663940
C -2.438837 -0.460800 -0.199937
C 3.667964 0.280173 -0.852695
C 4.269431 -0.417821 0.364333
C 1.295404 0.309916 -0.304068
C -4.890363 -0.649360 0.159286
C -3.751042 1.563605 0.551993
C 5.757672 -0.114512 0.488054
H -1.336156 1.311454 -0.812406
H -1.010159 0.792815 0.848579
H 0.008572 -1.414569 -0.220799
H -0.039587 -0.578665 -1.758936
H 3.634939 1.377584 -0.741923
H 4.152041 -0.004904 -1.803630
H 3.732466 -0.093123 1.280629
H 4.100959 -1.511079 0.288652
H -4.674983 -1.691060 -0.159348
H -5.628304 -0.227291 -0.541096
H -5.327335 -0.689597 1.169679
H -3.458590 2.232897 -0.276065
H -3.111688 1.782370 1.425610
H -4.786808 1.818735 0.831763
H 5.945545 0.960532 0.597619
H 6.185878 -0.608416 1.369225
H 6.320732 -0.463838 -0.385268


%chk=000245427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245427

0 1
O 2.338364 -0.164215 -1.114546
O -2.402451 -1.723281 -0.255542
O 1.466166 1.093053 0.647650
N -3.687659 0.167725 0.171426
C -1.228070 0.432069 -0.206939
C -0.010518 -0.372379 -0.693728
C -2.476452 -0.460224 -0.105471
C 3.711302 0.325085 -0.781942
C 4.377020 -0.575059 0.268151
C 1.299143 0.279466 -0.293639
C -4.917581 -0.640731 0.237894
C -3.857247 1.614102 0.373984
C 5.827112 -0.122799 0.550969
H -1.415914 1.287718 -0.882057
H -0.991989 0.864277 0.785906
H -0.055702 -1.387441 -0.251806
H -0.024923 -0.530392 -1.784969
H 3.639718 1.367508 -0.421532
H 4.245009 0.289048 -1.746297
H 3.782970 -0.541179 1.199848
H 4.367909 -1.620633 -0.093001
H -4.651307 -1.688743 0.034074
H -5.652997 -0.293892 -0.513796
H -5.377988 -0.569020 1.242096
H -4.318025 2.097940 -0.511363
H -2.896323 2.105615 0.581432
H -4.520133 1.790805 1.241889
H 5.855310 0.912906 0.937790
H 6.299887 -0.776000 1.305525
H 6.447869 -0.161326 -0.364006


