%chk=000186357.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186357

0 1
O -0.279574 -3.485262 -0.146346
O -3.132934 -2.987045 0.169183
C -0.310948 0.182432 0.088233
C -0.839712 -2.274237 0.392181
C 0.166627 -1.177365 0.150919
C -1.731626 0.458355 0.065859
C -2.201935 -1.999533 -0.292765
C -2.691639 -0.591232 -0.066438
C 0.611293 1.235569 0.057777
C -2.183746 1.795375 0.144465
C 2.033144 0.949610 -0.024009
C 1.500948 -1.452116 0.072560
C 2.473156 -0.397430 -0.042895
C 0.119684 2.589593 0.113669
C -4.042209 -0.307160 -0.062207
C -1.213968 2.859762 0.178360
C -3.583290 2.063397 0.165188
C 3.875871 -0.680074 -0.157004
C 2.997063 1.995671 -0.098854
C -4.490526 1.031196 0.073439
C 4.782318 0.362434 -0.232624
C 4.338988 1.706009 -0.200179
C 4.361312 -2.093128 -0.196524
H -0.975945 -2.430099 1.490407
H -2.141831 -2.224227 -1.389437
H 1.839844 -2.492511 0.100363
H 0.851685 3.400907 0.112235
H -4.774548 -1.108113 -0.179167
H -1.577225 3.884814 0.242784
H -3.920985 3.095607 0.248125
H 2.657597 3.031560 -0.078428
H -5.561864 1.228418 0.089248
H -0.975770 -4.183451 -0.173680
H -3.412082 -2.804250 1.091820
H 5.849084 0.164553 -0.318964
H 5.076452 2.505916 -0.258971
H 5.449851 -2.163605 -0.321371
H 4.110739 -2.629694 0.730569
H 3.908600 -2.649547 -1.031420


%chk=000186357-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186357

0 1
O -0.302768 -3.566226 0.040827
O -3.135179 -3.077566 0.032388
C -0.312541 0.194496 0.084422
C -0.848943 -2.260900 0.405872
C 0.166494 -1.167362 0.137612
C -1.742947 0.459476 0.082527
C -2.176813 -2.009901 -0.332535
C -2.697582 -0.603733 -0.072549
C 0.624579 1.272932 0.053357
C -2.216911 1.814658 0.172941
C 2.055129 0.986468 -0.034329
C 1.520432 -1.442746 0.051369
C 2.498140 -0.390798 -0.064921
C 0.109960 2.620173 0.123381
C -4.071665 -0.324030 -0.066605
C -1.249228 2.880869 0.209062
C -3.623925 2.068445 0.194564
C 3.903685 -0.699158 -0.177876
C 3.038793 2.022151 -0.105402
C -4.537910 1.014503 0.090863
C 4.826892 0.354995 -0.248012
C 4.398113 1.712155 -0.209940
C 4.386772 -2.138062 -0.220040
H -1.086835 -2.251806 1.500144
H -2.016932 -2.177070 -1.414607
H 1.836414 -2.488058 0.082908
H 0.806141 3.463294 0.123716
H -4.784674 -1.142234 -0.214665
H -1.608915 3.913823 0.283196
H -3.976111 3.103187 0.278416
H 2.737662 3.073290 -0.087926
H -5.614751 1.214495 0.103432
H -1.068063 -4.200840 0.041802
H -3.455095 -2.902857 0.956553
H 5.896128 0.129229 -0.334123
H 5.139960 2.516318 -0.267795
H 5.483264 -2.178748 -0.330990
H 4.121459 -2.686641 0.703666
H 3.939670 -2.695123 -1.064602


