%chk=000202295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202295

0 1
O -0.270057 1.279557 0.357358
O -1.038065 0.680737 -1.744408
O 4.185612 -3.178101 0.166675
N 3.078878 2.280957 -0.275708
C 0.983319 3.315384 0.876805
C 0.553442 2.373256 -0.265212
C 1.836510 2.539430 1.918509
C 1.851770 4.438036 0.238629
C 1.841883 1.795712 -0.949243
C 3.046872 1.875336 1.166119
C 3.142487 3.772210 -0.369856
C -1.016363 0.498634 -0.513668
C -1.773959 -0.598441 0.235000
C -1.432798 -1.989793 -0.410339
C -3.283439 -0.336005 0.235513
C 0.044139 -2.337621 -0.308717
C -3.995045 -0.325810 1.461181
C -3.998619 -0.139287 -0.974698
C 0.932610 -2.087881 -1.381579
C 0.583574 -2.879686 0.890093
C -5.394823 -0.130147 1.482206
C -5.396436 0.059875 -0.954024
C -6.100890 0.062538 0.272943
C 2.318060 -2.352192 -1.273879
C 1.957382 -3.151815 1.018070
C 2.832570 -2.881495 -0.064846
C 5.134071 -2.875382 -0.908236
H 0.088077 3.746002 1.358621
H -0.094915 2.887953 -0.997463
H 2.187943 3.248060 2.692222
H 1.215112 1.777905 2.419493
H 1.274209 4.971294 -0.541373
H 2.113125 5.181503 1.014439
H 1.824771 0.692541 -0.903759
H 1.876541 2.090375 -2.012611
H 4.011133 2.162616 1.622784
H 2.975599 0.773345 1.199586
H 3.266988 4.044620 -1.433641
H 4.050251 4.102648 0.166278
H -1.409846 -0.595821 1.277057
H -1.755395 -1.964031 -1.466740
H -2.050936 -2.746974 0.107587
H -3.450521 -0.470414 2.402612
H -3.453987 -0.120916 -1.925556
H 0.538831 -1.669509 -2.315490
H -0.084555 -3.096620 1.733288
H -5.930869 -0.125164 2.438095
H -5.936703 0.215239 -1.894847
H -7.185835 0.216053 0.286391
H 2.973738 -2.143160 -2.124537
H 2.376232 -3.572355 1.937551
H 6.119028 -3.161517 -0.511017
H 4.913985 -3.466212 -1.818947
H 5.129311 -1.795867 -1.155613


%chk=000202295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202295

0 1
O -0.277582 1.283555 0.361905
O -1.052653 0.697995 -1.756054
O 4.181376 -3.130768 0.201048
N 3.081475 2.275483 -0.326761
C 1.018114 3.285358 0.901370
C 0.557437 2.372880 -0.252643
C 1.889562 2.477452 1.902648
C 1.875709 4.422149 0.274230
C 1.826956 1.786688 -0.964477
C 3.100437 1.858500 1.111795
C 3.133038 3.767429 -0.411372
C -1.030626 0.510696 -0.514131
C -1.791295 -0.585107 0.234425
C -1.441590 -1.978589 -0.402785
C -3.302242 -0.332137 0.227049
C 0.036444 -2.319169 -0.293775
C -4.024386 -0.362234 1.446351
C -4.009344 -0.110502 -0.983640
C 0.925029 -2.083730 -1.369685
C 0.576916 -2.838235 0.914721
C -5.426097 -0.180679 1.460662
C -5.409267 0.074781 -0.969429
C -6.123915 0.037877 0.250965
C 2.311625 -2.339654 -1.256004
C 1.951812 -3.101428 1.048951
C 2.827137 -2.845241 -0.037356
C 5.130218 -2.838749 -0.876548
H 0.135561 3.706093 1.414336
H -0.091208 2.913692 -0.965844
H 2.240140 3.154666 2.704179
H 1.279530 1.688188 2.373936
H 1.275734 4.995573 -0.458877
H 2.177129 5.128775 1.069860
H 1.810300 0.684129 -0.905409
H 1.834491 2.068542 -2.031694
H 4.066965 2.175912 1.543145
H 3.067756 0.754470 1.140213
H 3.194786 4.047017 -1.478839
H 4.068236 4.099593 0.074019
H -1.432545 -0.577253 1.278355
H -1.760425 -1.959095 -1.460551
H -2.058947 -2.735467 0.116504
H -3.486332 -0.526473 2.388315
H -3.457084 -0.063726 -1.929050
H 0.530579 -1.682740 -2.310948
H -0.091129 -3.043843 1.760813
H -5.970098 -0.206543 2.411719
H -5.943298 0.249686 -1.910403
H -7.210386 0.180586 0.259211
H 2.967323 -2.142224 -2.109426
H 2.371550 -3.503927 1.976069
H 6.116478 -3.109414 -0.471793
H 4.917676 -3.447401 -1.777236
H 5.116927 -1.763842 -1.142969


