%chk=000241388.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241388

0 1
O 1.553424 -3.023368 -2.287321
O -1.445585 -1.097755 1.909736
N 3.520090 -0.850232 0.442545
N -3.440892 -0.742078 -0.064282
C 1.453569 -2.124045 -0.005875
C -1.367554 -2.021593 -0.364306
C 2.946726 -2.204387 0.168552
C -2.863851 -2.040678 -0.538660
C 0.839648 -2.538468 -1.208005
C -0.757293 -1.585981 0.832789
C 0.637909 -1.640863 1.014959
C -0.546368 -2.493512 -1.394245
C 4.964595 -0.770332 0.057826
C -4.937409 -0.738513 -0.128532
C 5.423768 0.667740 0.078615
C -5.453070 0.673578 0.009163
C 6.088424 1.210672 -1.030179
C 5.202829 1.460586 1.215136
C -5.124224 1.435497 1.140460
C -6.272172 1.223947 -0.986786
C 6.531847 2.536313 -0.998322
C 5.644124 2.785488 1.239808
C -5.612793 2.737588 1.272484
C -6.761830 2.526089 -0.847615
C 6.310819 3.325253 0.134500
C -6.433389 3.284427 0.280187
H 3.189156 -2.844582 1.052209
H 3.409017 -2.709479 -0.717675
H -3.134413 -2.277353 -1.592282
H -3.288557 -2.865570 0.083747
H 1.066672 -1.293916 1.957992
H -0.961344 -2.832838 -2.342363
H 2.984575 -0.130850 -0.059653
H -3.064419 0.030464 -0.630849
H 5.544122 -1.351036 0.816101
H 5.183478 -1.239889 -0.927052
H -5.313252 -1.357629 0.721189
H -5.331622 -1.214373 -1.054361
H 6.262681 0.606158 -1.917431
H 4.677563 1.036901 2.072872
H -4.481358 1.010640 1.911386
H -6.531105 0.642758 -1.869389
H 2.530567 -3.031427 -2.094061
H -2.413193 -0.900112 1.678557
H 7.049373 2.954569 -1.859790
H 5.468497 3.398781 2.122167
H -5.353503 3.327381 2.150620
H -7.399701 2.950217 -1.621412
H 6.655572 4.356844 0.156516
H -6.814551 4.298268 0.385826


%chk=000241388-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241388

0 1
O 1.282296 -4.035963 -2.064931
O -1.343226 -0.170512 1.087402
N 3.519883 -0.711130 -0.347677
N -3.518722 -0.811355 -0.186830
C 1.432894 -2.056628 -0.544346
C -1.419424 -2.123449 -0.394253
C 2.958217 -2.045670 -0.593193
C -2.927366 -2.191829 -0.211924
C 0.684326 -3.032285 -1.262397
C -0.679099 -1.122728 0.311189
C 0.729732 -1.105929 0.231430
C -0.723895 -3.058638 -1.186313
C 4.993045 -0.647163 -0.300756
C -4.930796 -0.754348 0.293048
C 5.493370 0.730853 0.120093
C -5.469915 0.668753 0.267008
C 6.655055 1.285218 -0.472255
C 4.822458 1.464749 1.131541
C -4.793462 1.710445 0.954783
C -6.662451 0.972627 -0.434835
C 7.146974 2.543836 -0.055757
C 5.308437 2.724720 1.544949
C -5.302144 3.027224 0.937923
C -7.176351 2.290262 -0.449188
C 6.474416 3.268059 0.955211
C -6.496193 3.321417 0.237096
H 3.363972 -2.728935 0.183257
H 3.311031 -2.472825 -1.577444
H -3.394588 -2.835910 -0.986016
H -3.164901 -2.640818 0.774984
H 1.288195 -0.348279 0.787210
H -1.259915 -3.831989 -1.747400
H 3.108682 0.010237 -0.953933
H -3.424719 -0.352085 -1.105951
H 5.327000 -1.403593 0.441126
H 5.478171 -0.930523 -1.268616
H -4.931006 -1.150550 1.328090
H -5.591778 -1.418236 -0.307324
H 7.176772 0.731078 -1.263113
H 3.918123 1.036925 1.577380
H -3.869508 1.491311 1.502563
H -7.192166 0.175603 -0.971617
H 2.255408 -3.872222 -2.152685
H -2.338216 -0.204760 0.754738
H 8.046813 2.960137 -0.522976
H 4.780002 3.282368 2.326757
H -4.770449 3.822385 1.472232
H -8.100473 2.510117 -0.995353
H 6.851514 4.245645 1.276439
H -6.890427 4.343683 0.226132


