%chk=000210561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210561

0 1
O 5.243665 -0.594247 -0.731398
O -1.316458 -0.095852 2.066886
N 2.606242 -0.624186 0.313469
C 0.139123 -0.961137 0.313459
C 1.310478 -0.101865 0.850459
C 2.825077 -0.257992 -1.121825
C 3.756485 -0.331997 1.225521
C -1.215949 -0.254860 0.629582
C 4.137905 -0.926428 -1.592502
C 5.017307 -1.003345 0.630837
C 0.177206 -2.367679 0.913784
C 2.837314 1.241593 -1.440883
C 4.026050 1.149230 1.517272
C -1.278850 1.162291 0.071571
C -2.436279 -1.034610 0.145964
C -1.509508 2.248780 0.926537
C -2.424202 -1.744236 -1.062262
C -1.112485 1.384131 -1.303570
C -3.607178 -1.005578 0.917823
C -1.565593 3.546684 0.411370
C -3.567528 -2.428863 -1.485448
C -1.168547 2.683576 -1.814151
C -4.747537 -1.691626 0.493833
C -1.393518 3.766932 -0.958535
C -4.729525 -2.406326 -0.708343
H 0.239068 -1.044944 -0.798294
H 1.147211 0.969963 0.593397
H 1.318647 -0.151335 1.960822
H 1.973350 -0.730537 -1.687041
H 3.515810 -0.847322 2.195921
H 4.034131 -2.024854 -1.633459
H 4.478141 -0.540474 -2.568918
H 5.943755 -0.673319 1.131632
H 4.937611 -2.103935 0.666295
H 1.169752 -2.817053 0.757497
H -0.002454 -2.358738 1.995013
H -0.563909 -3.031230 0.454879
H 3.716666 1.729678 -0.990534
H 2.878446 1.422804 -2.518435
H 1.943161 1.746020 -1.054167
H 4.359773 1.670191 0.604598
H 3.135299 1.666613 1.885016
H 4.812445 1.272029 2.267982
H -1.171633 -0.963701 2.506318
H -1.644883 2.072418 1.997040
H -1.526765 -1.769265 -1.678366
H -0.948393 0.547247 -1.979573
H -3.620002 -0.434501 1.849138
H -1.745992 4.386679 1.079921
H -3.551951 -2.979519 -2.424266
H -1.040706 2.851605 -2.881908
H -5.652464 -1.665184 1.098470
H -1.437974 4.777717 -1.358788
H -5.618135 -2.939942 -1.039440


%chk=000210561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210561

0 1
O 5.322890 -0.709887 -0.658111
O -1.319379 -0.140896 2.135537
N 2.630180 -0.452008 0.254996
C 0.142639 -0.892175 0.274511
C 1.314343 0.027874 0.728335
C 2.947227 -0.158494 -1.171404
C 3.744485 -0.331781 1.236514
C -1.247669 -0.259523 0.657510
C 4.196416 -0.976908 -1.567584
C 4.953548 -1.132048 0.703580
C 0.333655 -2.313848 0.848600
C 3.116982 1.340733 -1.555403
C 4.153071 1.114589 1.640670
C -1.376541 1.180215 0.114122
C -2.458012 -1.090162 0.161604
C -1.431131 2.292986 0.987882
C -2.413020 -1.915432 -0.990791
C -1.439200 1.403139 -1.284911
C -3.689855 -0.970346 0.857198
C -1.537711 3.604440 0.470608
C -3.563464 -2.608404 -1.430436
C -1.537926 2.713180 -1.801683
C -4.839750 -1.662463 0.420811
C -1.586656 3.822263 -0.925009
C -4.782414 -2.487081 -0.726577
H 0.174928 -0.952441 -0.832396
H 1.107201 1.069188 0.402949
H 1.323066 0.045359 1.834559
H 2.101668 -0.560230 -1.768683
H 3.397568 -0.850193 2.155217
H 3.954823 -2.062102 -1.544039
H 4.556071 -0.693883 -2.571057
H 5.851143 -0.956532 1.319975
H 4.706375 -2.216230 0.695449
H 1.330731 -2.681533 0.550716
H 0.314977 -2.306326 1.957186
H -0.432268 -3.024762 0.494554
H 4.093358 1.730380 -1.221429
H 3.063418 1.454818 -2.654897
H 2.318016 1.966047 -1.118444
H 4.748732 1.599871 0.849385
H 3.261790 1.736322 1.839944
H 4.764564 1.093246 2.563018
H -1.350065 -1.059316 2.505338
H -1.390493 2.117980 2.065872
H -1.479980 -2.033316 -1.552977
H -1.434070 0.553670 -1.977646
H -3.736026 -0.319276 1.736403
H -1.580638 4.456120 1.159396
H -3.505469 -3.243897 -2.321526
H -1.586986 2.867436 -2.885680
H -5.781406 -1.553631 0.971044
H -1.667908 4.839385 -1.324677
H -5.674126 -3.024613 -1.067921


