%chk=000225638.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225638

0 1
O 7.777453 -0.149080 -1.474288
N 0.382843 0.159791 0.343193
N 6.839526 -0.039890 0.632146
C -4.291853 -1.592209 0.958326
C -3.203542 -0.662722 0.471021
C -3.777061 0.440449 -0.238645
C -5.555104 -0.926075 0.462921
C -5.235626 0.276602 -0.243406
C -1.837012 -0.772806 0.636057
C -2.966085 1.428668 -0.776184
C -6.869965 -1.329956 0.613455
C -6.240954 1.060082 -0.790261
C -1.018113 0.239381 0.075876
C -1.574707 1.323394 -0.622232
C -7.884432 -0.528849 0.054871
C -7.575716 0.643671 -0.633676
C 1.268313 0.178442 -0.603514
C 2.706169 0.120225 -0.274661
C 3.644967 0.042780 -1.319524
C 3.161119 0.141643 1.056003
C 5.455163 0.011673 0.283427
C 5.009640 -0.011569 -1.051158
C 4.522772 0.088735 1.341256
C 7.928933 -0.118001 -0.271509
C 9.269464 -0.157472 0.407300
H -4.283332 -1.690485 2.060855
H -4.175395 -2.613324 0.548401
H -1.386091 -1.597595 1.182917
H -3.394501 2.273709 -1.311331
H -7.123220 -2.241144 1.148147
H -6.008802 1.975576 -1.327797
H -0.929987 2.098192 -1.030292
H -8.923474 -0.834513 0.165707
H -8.374812 1.249148 -1.057719
H 1.042417 0.225897 -1.683957
H 3.308179 0.023450 -2.357353
H 2.433371 0.200151 1.871940
H 5.730045 -0.072160 -1.875033
H 4.853448 0.107133 2.376616
H 7.041933 -0.017111 1.634156
H 9.468525 0.742838 1.003734
H 10.068597 -0.217766 -0.352374
H 9.387806 -1.032804 1.059784


%chk=000225638-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225638

0 1
O 7.942713 0.388506 -1.504094
N 0.381437 -0.067254 0.364585
N 6.909620 -0.101422 0.548890
C -4.416424 -1.472935 1.205156
C -3.275345 -0.665803 0.595353
C -3.801498 0.328471 -0.288691
C -5.655247 -0.837249 0.582644
C -5.270671 0.223992 -0.295325
C -1.896146 -0.779948 0.805721
C -2.926582 1.213464 -0.958969
C -7.011739 -1.156319 0.764585
C -6.250122 0.967140 -0.992686
C -1.004360 0.084358 0.104896
C -1.536697 1.088185 -0.764083
C -7.993774 -0.410219 0.064138
C -7.613621 0.641990 -0.806545
C 1.286969 0.174736 -0.555309
C 2.725832 0.102910 -0.274055
C 3.667288 0.347731 -1.310217
C 3.216119 -0.208950 1.026763
C 5.529369 -0.021721 0.221549
C 5.054776 0.290376 -1.081647
C 4.593976 -0.270768 1.269829
C 8.024639 0.096318 -0.276868
C 9.360200 -0.079255 0.446422
H -4.426440 -1.402528 2.310626
H -4.336769 -2.549973 0.958526
H -1.468836 -1.521079 1.488954
H -3.318058 1.998293 -1.616069
H -7.312821 -1.968721 1.436239
H -5.964191 1.782083 -1.667348
H -0.853429 1.792249 -1.252887
H -9.055390 -0.647738 0.195809
H -8.386059 1.207987 -1.339410
H 1.012936 0.421887 -1.603382
H 3.305018 0.587752 -2.317898
H 2.488774 -0.397222 1.822567
H 5.772540 0.479548 -1.881036
H 4.959141 -0.512588 2.276937
H 7.112319 -0.334782 1.524489
H 9.465490 0.641363 1.278694
H 10.172564 0.092931 -0.273724
H 9.463399 -1.099699 0.860065


