%chk=000267168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267168

0 1
O -0.172494 0.049429 -1.931127
O -4.741458 0.145685 -3.301828
O -3.216086 -0.060725 3.548276
O -6.339728 0.125427 -1.833962
O -5.286557 -0.016790 2.900131
O 3.978594 0.036757 -3.429380
O 4.009273 -0.154522 3.591174
O 5.860736 -0.016340 -2.356256
O 5.882570 -0.149166 2.501060
N -0.433195 0.019880 -0.724770
N 0.395305 -0.017492 0.255878
N -5.171924 0.119905 -2.166950
N -4.088510 -0.026664 2.703738
N 4.645666 0.000669 -2.413441
N 4.668884 -0.135295 2.568870
C -1.861919 0.027826 -0.344172
C 1.813251 -0.031111 0.088344
C -2.267454 -0.003563 0.999469
C -2.801715 0.068368 -1.390565
C -4.163446 0.077025 -1.067644
C -3.641649 0.006376 1.280683
C -4.603772 0.046405 0.263381
C 2.521742 -0.073479 1.311361
C 2.506445 -0.006741 -1.133850
C 3.909051 -0.025175 -1.117501
C 3.918550 -0.090630 1.282426
C 4.634999 -0.066983 0.075913
H -1.533247 -0.035467 1.826230
H -2.469013 0.092894 -2.447565
H -5.683771 0.053693 0.503169
H 1.982948 -0.092681 2.271788
H 1.968626 0.026447 -2.100177
H 5.738697 -0.081059 0.072497


%chk=000267168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267168

0 1
O -0.158099 0.046475 -2.008054
O -4.752612 0.145823 -3.369725
O -3.163370 -0.062235 3.607340
O -6.430349 0.128924 -1.819964
O -5.346285 -0.011149 2.938457
O 3.974641 0.042837 -3.493751
O 3.974173 -0.156695 3.662808
O 5.949291 -0.011569 -2.350481
O 5.952481 -0.151481 2.523164
N -0.443425 0.015017 -0.724912
N 0.396126 -0.021288 0.296305
N -5.189030 0.120431 -2.159483
N -4.081092 -0.024345 2.705366
N 4.663053 0.002751 -2.407273
N 4.666753 -0.136365 2.577333
C -1.873158 0.025349 -0.356064
C 1.794338 -0.032135 0.084492
C -2.264752 -0.004767 0.997347
C -2.810749 0.066460 -1.405665
C -4.175293 0.076900 -1.061373
C -3.643384 0.007551 1.276248
C -4.626808 0.048228 0.270172
C 2.521735 -0.074931 1.310079
C 2.507528 -0.006280 -1.153506
C 3.914643 -0.024590 -1.110578
C 3.922633 -0.091295 1.282857
C 4.658683 -0.066884 0.081886
H -1.528580 -0.036512 1.802608
H -2.487088 0.089475 -2.449333
H -5.692725 0.057145 0.512152
H 1.986543 -0.094934 2.262932
H 1.992176 0.027004 -2.113301
H 5.751404 -0.080011 0.077116


