%chk=000215322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215322

1 1
O -1.721697 2.711705 -0.017120
N -2.509898 -0.612071 -0.343801
N -0.470405 0.869063 -0.476694
N 0.686357 0.140439 -0.458397
C -3.076735 0.234908 0.802315
C -3.649633 -1.097044 -1.255138
C -4.181015 -0.486976 1.574737
C -4.740614 -1.837027 -0.476865
C -5.301579 -0.973728 0.654529
C -1.569112 0.254595 -1.237363
C -1.743020 -1.794874 0.200695
C -0.611505 2.226662 0.036240
C 1.770083 0.696664 0.056611
C 0.630099 2.780311 0.571735
C 1.774233 2.063811 0.582880
C 3.018771 -0.100131 0.087628
C 4.156000 0.384110 -0.578696
C 3.066071 -1.317548 0.781921
C 5.341363 -0.353374 -0.541553
C 4.259107 -2.045582 0.816132
C 5.394880 -1.565525 0.156477
H -3.459527 1.198511 0.376307
H -2.248571 0.517679 1.492246
H -3.229452 -1.755198 -2.049442
H -4.098250 -0.209942 -1.764076
H -4.595057 0.213863 2.335968
H -3.769415 -1.331939 2.163419
H -4.365026 -2.802270 -0.079819
H -5.555624 -2.117392 -1.182229
H -6.048217 -1.552702 1.239442
H -5.866822 -0.112062 0.242850
H -1.164184 -0.403207 -2.053011
H -2.191787 1.075637 -1.694143
H -2.403905 -2.481166 0.761871
H -1.256611 -2.373337 -0.606572
H -0.936094 -1.473474 0.887317
H 0.562356 3.810090 0.946151
H 2.716408 2.463355 0.976713
H 4.117166 1.323222 -1.129769
H 2.183226 -1.694114 1.293905
H 6.228452 0.016583 -1.059116
H 4.304138 -2.990703 1.359138
H 6.324948 -2.136623 0.185076


%chk=000215322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215322

1 1
O -1.803912 2.738555 -0.798345
N -2.501939 -0.709084 -0.289558
N -0.507208 0.775396 -0.790674
N 0.660064 0.034451 -0.581755
C -2.902511 0.266598 0.849053
C -3.776732 -1.169754 -1.041484
C -3.969686 -0.323666 1.785617
C -4.820696 -1.795379 -0.104996
C -5.218421 -0.809338 1.016507
C -1.612520 0.027400 -1.347443
C -1.730689 -1.905261 0.260033
C -0.669838 2.201589 -0.615055
C 1.756951 0.712419 -0.190458
C 0.566368 2.872082 -0.230802
C 1.724655 2.158502 -0.019494
C 2.993868 -0.077254 0.030480
C 4.035150 0.421658 0.861612
C 3.150291 -1.353843 -0.578494
C 5.203140 -0.338997 1.077470
C 4.319094 -2.108838 -0.363318
C 5.350985 -1.604440 0.465186
H -3.258401 1.183098 0.347670
H -1.975229 0.510052 1.393815
H -3.448017 -1.868215 -1.831069
H -4.193233 -0.263095 -1.516583
H -4.243923 0.476937 2.496667
H -3.550849 -1.144197 2.398034
H -4.452993 -2.748165 0.319763
H -5.699804 -2.053297 -0.723367
H -5.925460 -1.292623 1.712253
H -5.747383 0.058854 0.576369
H -1.228118 -0.755139 -2.018321
H -2.276124 0.735439 -1.867687
H -2.286818 -2.354833 1.092178
H -1.603030 -2.645598 -0.545248
H -0.740910 -1.563405 0.595712
H 0.521299 3.959641 -0.130367
H 2.647605 2.681410 0.243691
H 3.935808 1.388176 1.367486
H 2.358096 -1.733806 -1.230766
H 5.994621 0.053343 1.723808
H 4.434781 -3.084036 -0.847430
H 6.261569 -2.190138 0.627811


