%chk=000223563.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223563

0 1
O -1.545789 -0.798816 0.011296
O 3.676372 -2.355517 -0.006430
O 4.883506 2.105064 -0.060511
N 0.731986 -1.393731 0.003744
N 2.626534 1.659910 -0.037751
N 4.282852 -0.132538 -0.025577
N 0.247405 0.875226 -0.015792
C -5.031027 0.548445 0.017456
C -3.854495 -0.434670 0.019526
C 1.962028 -0.689770 -0.010031
C 1.627799 0.692710 -0.021979
C -6.372987 -0.195301 0.032096
C -2.530414 0.316195 0.005263
C -0.254115 -0.416588 0.000046
C -7.555499 0.783855 0.030037
C 3.307711 -1.196436 -0.011948
C 4.004455 1.264109 -0.041174
C 0.580320 -2.848830 0.019572
C 2.274676 3.100342 -0.054126
C -8.893909 0.049467 0.044485
C 5.725071 -0.503766 -0.007118
H -4.965505 1.221085 0.895527
H -4.975839 1.204931 -0.873461
H -3.912674 -1.114149 -0.855627
H -3.902561 -1.098378 0.907318
H -6.443384 -0.868835 -0.843981
H -6.433088 -0.852670 0.921126
H -2.359891 0.911467 -0.907374
H -2.350516 0.929356 0.904151
H -7.489838 1.457050 0.907396
H -7.500095 1.440973 -0.860118
H 0.022466 -3.194758 -0.869837
H 1.581791 -3.336739 0.015656
H 0.038310 -3.177037 0.925359
H 3.194633 3.716489 -0.053371
H 1.671148 3.355724 0.834970
H 1.684429 3.338920 -0.956651
H -9.732474 0.755320 0.042608
H -9.010147 -0.598208 -0.832057
H -9.000157 -0.581653 0.934272
H 5.842510 -1.564052 -0.300742
H 6.143539 -0.369266 1.004669
H 6.296264 0.130370 -0.708120


%chk=000223563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223563

0 1
O -1.481032 -0.931398 0.005328
O 3.819370 -2.389503 -0.018002
O 4.864416 2.213538 -0.024499
N 0.823466 -1.474489 -0.005397
N 2.591218 1.626825 -0.014211
N 4.312956 -0.065924 -0.021060
N 0.274805 0.759625 -0.003456
C -5.022095 0.521854 0.010164
C -3.871410 -0.512076 0.021603
C 2.035868 -0.746449 -0.010930
C 1.655389 0.604679 -0.009907
C -6.416490 -0.144005 0.035023
C -2.503016 0.164189 0.004252
C -0.180043 -0.524086 -0.001181
C -7.578490 0.874759 0.017643
C 3.401518 -1.186430 -0.016644
C 3.973895 1.315103 -0.020034
C 0.657371 -2.936690 -0.005054
C 2.161288 3.037656 -0.012397
C -8.967626 0.201590 0.045077
C 5.763833 -0.361931 -0.027197
H -4.925484 1.198932 0.884337
H -4.939455 1.162463 -0.892443
H -3.957280 -1.179714 -0.857282
H -3.949022 -1.151531 0.921934
H -6.514038 -0.824913 -0.836132
H -6.502936 -0.781732 0.939373
H -2.345480 0.780486 -0.900175
H -2.330447 0.797110 0.894219
H -7.479803 1.556280 0.887290
H -7.492784 1.510999 -0.886948
H 0.097124 -3.257805 -0.899511
H 1.660480 -3.389620 -0.009888
H 0.105591 -3.258401 0.894430
H 3.067844 3.660028 -0.011921
H 1.553897 3.247425 0.884081
H 1.553579 3.250170 -0.908071
H -9.780248 0.950864 0.032417
H -9.105435 -0.460628 -0.830474
H -9.091820 -0.415728 0.954816
H 5.872507 -1.456287 -0.028634
H 6.243400 0.074402 0.864273
H 6.236018 0.075663 -0.922015


