%chk=000212368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212368

0 1
O 0.989417 -1.343860 -0.190216
O 6.003018 -0.488481 -0.458879
N 1.034439 0.926028 -0.119558
N 6.357844 1.486608 0.583180
C -0.337051 -0.891206 -0.050746
C -0.312914 0.494259 0.004634
C 3.226870 -0.391427 -0.386680
C 1.773398 -0.168379 -0.228716
C -1.347551 -1.933569 -0.021276
C -1.401489 1.454848 0.176404
C 4.035186 0.735579 0.262449
C -2.635291 -1.678417 -0.524817
C -1.037288 -3.201759 0.501392
C -2.462636 1.168837 1.052689
C -1.383667 2.671656 -0.526404
C 5.518395 0.492258 0.078425
C -3.604128 -2.683392 -0.491479
C -2.012981 -4.200081 0.528638
C -3.501597 2.088579 1.210219
C -2.427879 3.584858 -0.363018
C -3.296420 -3.942431 0.035239
C -3.488110 3.294827 0.501884
H 3.483069 -0.473225 -1.471779
H 3.520807 -1.379923 0.041670
H 3.785036 0.813664 1.342653
H 3.735231 1.714731 -0.175574
H -2.874394 -0.699637 -0.943669
H -0.033200 -3.398597 0.878983
H -2.470587 0.234342 1.613301
H -0.548586 2.899122 -1.190541
H -4.602137 -2.485315 -0.880640
H -1.772334 -5.181901 0.934355
H -4.322596 1.866061 1.889900
H -2.413572 4.526429 -0.909753
H -4.055411 -4.722927 0.058652
H -4.300016 4.008687 0.626734
H 6.028767 2.326406 1.020202
H 7.357660 1.390049 0.488446


%chk=000212368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212368

0 1
O 0.971538 -1.470619 0.040626
O 5.923122 -0.139111 -1.011604
N 1.045019 0.804746 0.028540
N 6.301011 1.673447 0.383293
C -0.378508 -1.002578 0.084457
C -0.320656 0.395795 0.101545
C 3.249828 -0.478204 -0.077599
C 1.768588 -0.304203 -0.000522
C -1.408225 -2.044072 0.038224
C -1.372031 1.422110 0.234628
C 3.987684 0.854671 0.151267
C -2.692134 -1.791708 -0.523055
C -1.116384 -3.352303 0.519707
C -2.584133 1.180683 0.938216
C -1.146224 2.714864 -0.313302
C 5.473702 0.733265 -0.210464
C -3.661252 -2.814011 -0.576879
C -2.089053 -4.371149 0.460427
C -3.554170 2.197113 1.064252
C -2.119390 3.728231 -0.188713
C -3.368470 -4.107227 -0.082274
C -3.331109 3.473662 0.495830
H 3.545890 -0.882036 -1.064966
H 3.571756 -1.236194 0.660565
H 3.859975 1.198090 1.194495
H 3.530734 1.634595 -0.487862
H -2.922426 -0.803427 -0.932991
H -0.124895 -3.559189 0.934435
H -2.758099 0.206293 1.406521
H -0.199068 2.907559 -0.826798
H -4.642623 -2.604021 -1.016417
H -1.849025 -5.371435 0.837441
H -4.479686 1.996319 1.615574
H -1.932583 4.716914 -0.622826
H -4.123799 -4.899423 -0.127049
H -4.086775 4.261048 0.593647
H 5.947058 2.373065 1.033320
H 7.292114 1.671744 0.142618


