%chk=000214155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214155

0 1
O 1.074343 0.787258 -2.190357
O -1.787708 -0.680482 0.468896
N 0.565660 -3.067349 -0.611666
C 0.417676 -0.562260 -0.271559
C 1.296059 -1.762029 -0.696916
C 1.084241 0.766067 -0.742145
C 1.467044 -4.211797 -0.986000
C 0.093887 -3.394511 0.775532
C 2.047462 -4.813648 0.313661
C 1.169687 -4.268814 1.455827
C -1.024129 -0.663530 -0.785602
C 0.336934 2.036310 -0.358008
C 2.523664 0.873720 -0.241803
C -0.492323 2.097103 0.768904
C 2.799541 0.784264 1.130484
C 0.520068 3.181584 -1.149258
C 3.570167 1.093963 -1.146047
C -1.125545 3.297382 1.105901
C 4.115275 0.889665 1.588157
C -0.117661 4.377111 -0.811178
C 4.885839 1.198051 -0.685159
C -3.157084 -0.773081 0.402083
C -0.938363 4.438186 0.319973
C 5.161293 1.091561 0.681219
C -3.906639 -0.848295 -0.778749
C -3.768083 -0.786645 1.674384
C -5.299155 -0.938223 -0.674467
C -5.154294 -0.876992 1.743589
C -5.924931 -0.953321 0.573565
H 0.363444 -0.551225 0.853502
H 1.596045 -1.632536 -1.765150
H 2.233532 -1.751366 -0.096273
H 2.256329 -3.911853 -1.696396
H 0.826012 -4.953436 -1.509856
H -0.856831 -3.958683 0.656728
H -0.153755 -2.488711 1.359514
H 3.101420 -4.522438 0.451284
H 2.030042 -5.914763 0.281860
H 0.709286 -5.083747 2.036735
H 1.769083 -3.678771 2.168082
H -1.232848 -1.601206 -1.331183
H -1.338006 0.214139 -1.377580
H 1.333435 -0.092719 -2.549059
H -0.672803 1.207613 1.376019
H 1.988428 0.645903 1.844147
H 1.156445 3.124526 -2.034785
H 3.351251 1.201255 -2.210027
H -1.771690 3.338647 1.980998
H 4.325627 0.820167 2.654096
H 0.025244 5.261366 -1.429265
H 5.695587 1.368636 -1.392631
H -1.432852 5.370463 0.585106
H 6.185532 1.172992 1.039819
H -3.434914 -0.836896 -1.754770
H -3.152338 -0.726151 2.566187
H -5.898542 -0.996714 -1.583061
H -5.646494 -0.888508 2.715872
H -7.006695 -1.023230 0.641427


%chk=000214155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214155

0 1
O 0.998678 0.813536 -2.242949
O -1.932750 -0.698559 0.520474
N 0.379259 -3.016758 -0.341568
C 0.356359 -0.487629 -0.235498
C 1.145146 -1.773175 -0.621988
C 1.076892 0.803719 -0.758749
C 1.051091 -4.242766 -0.867295
C 0.221660 -3.328764 1.111905
C 2.077691 -4.702193 0.228316
C 1.532436 -4.067603 1.551671
C -1.110198 -0.550077 -0.705988
C 0.392768 2.117734 -0.324767
C 2.557278 0.850582 -0.295583
C -0.386358 2.219884 0.853631
C 2.884162 0.737849 1.081269
C 0.620611 3.285129 -1.097673
C 3.604992 1.049124 -1.226848
C -0.920509 3.466150 1.254015
C 4.226101 0.798180 1.511468
C 0.083768 4.527466 -0.700259
C 4.951471 1.107852 -0.797754
C -3.314129 -0.880017 0.361142
C -0.685523 4.625770 0.483050
C 5.269259 0.977829 0.571980
C -3.980613 -0.881911 -0.890155
C -4.048148 -1.067779 1.560160
C -5.381416 -1.073564 -0.927614
C -5.442974 -1.256964 1.505427
C -6.120664 -1.262147 0.260734
H 0.330647 -0.438983 0.868441
H 1.338283 -1.781146 -1.715950
H 2.140297 -1.745642 -0.121730
H 1.517237 -4.044290 -1.848012
H 0.281349 -5.025327 -1.009943
H -0.647111 -4.005377 1.219931
H -0.000570 -2.420199 1.692318
H 3.092424 -4.329761 0.001687
H 2.134853 -5.803297 0.287302
H 1.324756 -4.828184 2.324619
H 2.263768 -3.356624 1.976327
H -1.270662 -1.438671 -1.343630
H -1.408264 0.370770 -1.240213
H 1.419651 -0.018165 -2.581801
H -0.615891 1.333147 1.452082
H 2.088239 0.622355 1.826243
H 1.208424 3.205192 -2.016530
H 3.363441 1.181820 -2.286575
H -1.529233 3.525010 2.163310
H 4.458824 0.712349 2.578983
H 0.266193 5.418779 -1.311442
H 5.749089 1.263090 -1.533352
H -1.101254 5.590658 0.794686
H 6.311653 1.026068 0.905988
H -3.429238 -0.733478 -1.822591
H -3.509278 -1.062836 2.513153
H -5.893706 -1.073160 -1.896663
H -6.003310 -1.401489 2.436197
H -7.205052 -1.409502 0.221211


