%chk=000228333.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228333

0 1
O -1.464854 -2.479196 -0.304338
C -1.144727 -0.041949 -0.113864
C 1.386702 -0.208818 0.090898
C 0.198397 0.018106 -0.865033
C -1.282855 -1.397481 0.623897
C 1.254388 -1.572907 0.791281
C -2.349356 0.183249 -1.066094
C -0.079476 -1.685684 1.536417
C 2.737003 -0.039457 -0.655878
C -3.697284 0.152891 -0.311733
C 3.915915 0.066235 0.335877
C -2.209904 1.485932 -1.863681
C 3.004735 -1.160361 -1.667714
C -3.854645 1.249675 0.748762
C 3.894510 1.356009 1.168301
C -5.169557 1.110075 1.513631
C 4.302875 2.588675 0.364927
H -1.151670 0.764072 0.660473
H 1.349364 0.587495 0.880551
H 0.306843 1.000974 -1.361397
H 0.211272 -0.731409 -1.678251
H -2.236997 -1.442409 1.201579
H 2.093709 -1.716154 1.498237
H 1.339972 -2.393522 0.053874
H -2.364904 -0.673062 -1.790487
H -0.186173 -2.704448 1.958294
H -0.096047 -0.993108 2.398242
H 2.682410 0.925185 -1.223566
H -3.826637 -0.844174 0.157421
H -4.519963 0.232474 -1.048740
H 4.870379 0.003948 -0.221803
H 3.912323 -0.809230 1.013577
H -1.377803 1.438339 -2.573697
H -2.039027 2.347330 -1.209434
H -3.117516 1.691635 -2.442379
H 2.158588 -1.291439 -2.351028
H 3.182886 -2.122495 -1.175804
H 3.886413 -0.938925 -2.279057
H -0.686040 -2.562469 -0.889391
H -3.807014 2.246316 0.268066
H -3.004281 1.215905 1.457847
H 4.573993 1.239470 2.035618
H 2.881949 1.507213 1.597248
H -6.034249 1.173530 0.843254
H -5.233107 0.148968 2.036276
H -5.277584 1.900438 2.264277
H 5.322272 2.495147 -0.026157
H 3.638768 2.747624 -0.492777
H 4.268004 3.493784 0.980976


%chk=000228333-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228333

0 1
O -1.504907 -2.441200 -0.060065
C -1.104440 0.042088 -0.133273
C 1.473585 -0.182539 0.016843
C 0.241434 -0.004204 -0.910251
C -1.244372 -1.228081 0.755447
C 1.311318 -1.462851 0.874138
C -2.329045 0.245882 -1.083297
C -0.015528 -1.430980 1.669286
C 2.821896 -0.098303 -0.769807
C -3.701532 0.141633 -0.354375
C 4.068540 -0.017744 0.159652
C -2.227276 1.574512 -1.877157
C 3.016507 -1.251873 -1.786237
C -3.944711 1.159986 0.786041
C 4.090946 1.140543 1.188915
C -5.352735 1.015770 1.404532
C 4.025614 2.547833 0.553178
H -1.057091 0.908427 0.563663
H 1.456701 0.678415 0.721914
H 0.367202 0.926342 -1.495273
H 0.200653 -0.829292 -1.654066
H -2.151253 -1.156794 1.378921
H 2.157835 -1.575631 1.577491
H 1.336664 -2.360646 0.220898
H -2.306760 -0.591474 -1.812818
H -0.150081 -2.368161 2.241496
H 0.019729 -0.598976 2.402511
H 2.778830 0.846207 -1.355230
H -3.827654 -0.885326 0.040427
H -4.500882 0.272249 -1.113738
H 4.966867 0.072919 -0.486900
H 4.180378 -0.981334 0.698863
H -1.382635 1.570710 -2.588622
H -2.093500 2.442325 -1.203092
H -3.149497 1.744534 -2.463955
H 2.181831 -1.317329 -2.507005
H 3.107803 -2.229960 -1.277238
H 3.944471 -1.097538 -2.367983
H -0.704063 -2.621845 -0.615219
H -3.817694 2.192135 0.403712
H -3.183990 1.026946 1.581573
H 5.023472 1.057836 1.782670
H 3.259594 1.024643 1.912873
H -6.137286 1.182962 0.642314
H -5.501506 -0.000134 1.817213
H -5.515435 1.741430 2.222901
H 4.841464 2.686795 -0.181424
H 3.068494 2.714273 0.025650
H 4.124046 3.336814 1.321402


