%chk=000212335.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212335

0 1
O -1.907375 0.111802 -0.990353
O 0.031572 -0.524574 -1.986457
O 1.532457 -0.040681 1.974331
N -0.060417 -0.050512 0.322427
N 2.172153 -0.801206 -0.122912
N 5.847232 -0.005375 -0.028643
C -2.392173 0.486522 0.376962
C -3.463582 -0.540418 0.736023
C -4.689797 -0.433960 -0.197040
C -2.912905 1.919008 0.254308
C -5.234573 1.007819 -0.201293
C -4.148525 1.990703 -0.652520
C -1.124653 0.377744 1.272387
C -5.772424 -1.428399 0.228357
C -0.572512 -0.196330 -0.993822
C 1.283360 -0.278429 0.805454
C 3.608216 -0.928257 0.225155
C 4.398184 0.325783 -0.213914
C 6.593584 1.141606 0.565601
C 6.471204 -0.426343 -1.317583
H -3.775222 -0.397262 1.788795
H -3.043247 -1.563911 0.671866
H -4.351097 -0.688218 -1.234779
H -2.117671 2.576669 -0.150755
H -3.159400 2.307474 1.262199
H -5.607000 1.280806 0.803183
H -6.107827 1.076993 -0.876670
H -3.846729 1.762444 -1.696664
H -4.545826 3.022491 -0.663642
H -0.844604 1.339150 1.754359
H -1.231476 -0.364219 2.092841
H -6.633014 -1.391146 -0.449635
H -5.398028 -2.458374 0.215817
H -6.144965 -1.226736 1.238313
H 1.912572 -0.907827 -1.111502
H 3.723720 -1.081795 1.325081
H 4.003369 -1.843371 -0.269702
H 4.139056 0.611119 -1.254375
H 4.097263 1.186692 0.421318
H 7.638459 0.835837 0.738582
H 6.161716 1.375597 1.552993
H 6.599014 2.058583 -0.040775
H 5.915253 -1.284208 -1.727772
H 7.497748 -0.774224 -1.116172
H 6.518512 0.356231 -2.088870


%chk=000212335-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212335

0 1
O -1.951946 0.580042 -1.216259
O -0.027172 -0.258666 -2.244081
O 1.563391 0.216525 1.717411
N -0.083715 0.332223 0.064130
N 2.059667 -0.542110 -0.450130
N 5.804577 -0.199456 0.165166
C -2.392149 0.842632 0.227129
C -3.205951 -0.384230 0.684656
C -4.521226 -0.568648 -0.113085
C -3.231190 2.127738 0.217115
C -5.358503 0.734306 -0.053621
C -4.555666 1.954356 -0.562667
C -1.039747 0.978345 0.985579
C -5.313222 -1.784507 0.410334
C -0.616108 0.171241 -1.223278
C 1.244922 0.002493 0.509697
C 3.435563 -0.950427 -0.123554
C 4.420887 0.246576 -0.107005
C 6.628836 0.827875 0.832365
C 6.479402 -0.765941 -1.019209
H -3.449217 -0.244834 1.759383
H -2.575675 -1.292402 0.610907
H -4.247885 -0.750230 -1.172560
H -2.629766 2.951259 -0.211321
H -3.447844 2.393128 1.272695
H -5.681749 0.909100 0.995296
H -6.279994 0.612146 -0.655031
H -4.322569 1.818966 -1.636043
H -5.157985 2.878039 -0.473184
H -0.759882 2.034811 1.154429
H -1.044612 0.461324 1.957913
H -6.239308 -1.936158 -0.174432
H -4.716659 -2.713550 0.344434
H -5.603405 -1.642933 1.469808
H 1.683787 -0.635446 -1.405015
H 3.452379 -1.422690 0.873115
H 3.747128 -1.704167 -0.867801
H 4.336220 0.810909 -1.070589
H 4.101758 0.926407 0.702835
H 7.606882 0.394033 1.110199
H 6.129500 1.161314 1.758744
H 6.822876 1.729251 0.196624
H 5.883023 -1.590481 -1.447206
H 7.459488 -1.181995 -0.724425
H 6.652461 -0.010873 -1.828969


