%chk=000188156.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188156

0 1
O -3.759739 -1.070212 0.461654
O 4.534621 0.396982 -0.509452
C -0.220392 -0.047074 0.009739
C 1.083465 -0.665457 -0.074580
C -0.349802 1.350038 -0.079919
C -1.381201 -0.889147 0.177574
C 2.225501 0.148735 -0.252654
C -1.658865 1.955870 0.011483
C 1.221602 -2.088733 0.019088
C -2.626102 -0.291856 0.240074
C -2.800976 1.132704 0.175768
C 0.837365 2.147667 -0.260255
C -1.200265 -2.330296 0.285345
C 2.070540 1.574871 -0.343266
C 0.023333 -2.895146 0.210302
C 3.502789 -0.490872 -0.335783
C 2.486953 -2.662358 -0.067783
C -1.849637 3.370765 -0.055812
C 3.636454 -1.871901 -0.246230
C -4.095029 1.724824 0.289384
C -3.105258 3.921177 0.044145
C -4.244704 3.088600 0.223063
C -4.391921 -1.551165 -0.771614
C 5.896568 -0.132785 -0.601745
C -5.574655 -2.366673 -0.253668
C 6.734152 1.132906 -0.779658
C -6.376230 -2.961561 -1.404677
C 8.214379 0.793440 -0.899011
H 0.722547 3.230525 -0.328282
H -2.104071 -2.920930 0.448599
H 2.974095 2.173204 -0.479573
H 0.156714 -3.973017 0.295976
H 2.602376 -3.744466 0.003007
H -0.974909 4.010145 -0.185902
H 4.604484 -2.356896 -0.309368
H -4.948806 1.061897 0.444487
H -3.245394 4.999817 -0.007560
H -5.226893 3.549195 0.310455
H -3.659117 -2.156869 -1.329261
H -4.696910 -0.678745 -1.372000
H 5.952154 -0.809782 -1.469970
H 6.127934 -0.672726 0.331145
H -5.205911 -3.165184 0.422438
H -6.217610 -1.724213 0.382219
H 6.385206 1.686333 -1.675867
H 6.556804 1.818658 0.074535
H -5.767224 -3.632321 -2.022349
H -7.224731 -3.547009 -1.029498
H -6.783662 -2.184904 -2.062749
H 8.418314 0.147634 -1.761445
H 8.814677 1.703166 -1.027604
H 8.590687 0.282344 -0.004747


%chk=000188156-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188156

0 1
O -3.820120 -1.088904 0.525884
O 4.586837 0.480281 -0.536909
C -0.241149 0.001549 0.068060
C 1.064936 -0.604472 -0.023807
C -0.392141 1.424197 -0.046807
C -1.402081 -0.852186 0.269007
C 2.223311 0.221647 -0.236397
C -1.717445 2.015138 0.060431
C 1.214705 -2.036758 0.097160
C -2.681311 -0.265180 0.333248
C -2.867418 1.155399 0.255323
C 0.791829 2.216376 -0.260634
C -1.217856 -2.284249 0.403578
C 2.052237 1.643293 -0.352826
C 0.037276 -2.849890 0.321153
C 3.515389 -0.398043 -0.327595
C 2.508643 -2.600039 0.002108
C -1.947805 3.427066 -0.018193
C 3.652391 -1.797112 -0.208984
C -4.175668 1.731373 0.378109
C -3.232981 3.967132 0.092334
C -4.359017 3.111745 0.296721
C -4.430285 -1.597264 -0.735266
C 5.944637 -0.085934 -0.643669
C -5.641469 -2.447334 -0.346513
C 6.905715 1.084985 -0.861657
C -6.345410 -3.041576 -1.586516
C 8.367853 0.604286 -0.990704
H 0.705210 3.302397 -0.354377
H -2.102979 -2.895987 0.600800
H 2.938386 2.262229 -0.515205
H 0.166793 -3.932946 0.433473
H 2.625299 -3.686084 0.094988
H -1.104162 4.108009 -0.162996
H 4.634418 -2.272617 -0.277510
H -5.018663 1.058980 0.562941
H -3.376943 5.051421 0.030021
H -5.360849 3.543175 0.398158
H -3.676564 -2.195993 -1.287660
H -4.726368 -0.735354 -1.368631
H 5.983412 -0.797041 -1.495482
H 6.191763 -0.635121 0.289068
H -5.305996 -3.256141 0.329680
H -6.346356 -1.820932 0.232015
H 6.600925 1.632423 -1.772992
H 6.807673 1.789528 -0.014852
H -5.663389 -3.695841 -2.161354
H -7.220059 -3.646417 -1.288498
H -6.702008 -2.245338 -2.266601
H 8.493176 -0.082446 -1.848824
H 9.047059 1.460937 -1.145355
H 8.700316 0.072835 -0.079246


