%chk=000197364.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197364

0 1
O 5.037628 -0.266571 0.152020
O -0.461979 2.804528 -0.215631
C 4.891011 -1.755470 0.251305
C 3.368946 -2.050508 0.276241
C 2.745491 -0.694199 0.147461
C 3.784240 0.280000 0.076753
C 1.427760 -0.293156 0.091958
C 1.142164 1.086693 -0.033919
C 5.628453 -2.324270 -0.940761
C 3.532368 1.641329 -0.046651
C 2.186925 2.025400 -0.100728
C -1.385257 0.612323 -0.022922
C -0.249472 1.612747 -0.101529
C -2.753385 1.301478 -0.102535
C -3.864391 0.291355 -0.025120
C -4.369912 -0.294576 -1.195952
C -4.398638 -0.077885 1.219051
C -5.399089 -1.236719 -1.120919
C -5.427737 -1.020523 1.288655
C -5.929972 -1.602260 0.120220
H 5.389385 -1.984381 1.214625
H 3.069532 -2.551869 1.214700
H 3.061814 -2.721717 -0.547084
H 0.626513 -1.028327 0.144990
H 5.153917 -2.038199 -1.889822
H 6.658512 -1.940201 -0.984300
H 5.680054 -3.418315 -0.904972
H 4.339177 2.366097 -0.097816
H 1.932417 3.088268 -0.198312
H -1.290827 -0.129175 -0.843051
H -1.311661 0.033194 0.920822
H -2.840759 2.056610 0.707951
H -2.818703 1.898753 -1.037291
H -3.962885 -0.012311 -2.164736
H -4.013957 0.373148 2.131465
H -5.789776 -1.685854 -2.032453
H -5.840746 -1.301089 2.256114
H -6.732159 -2.334347 0.176374


%chk=000197364-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197364

0 1
O 5.101690 -0.264706 0.150768
O -0.475792 2.907105 -0.206476
C 4.943483 -1.778745 0.238044
C 3.402413 -2.053820 0.268723
C 2.786642 -0.667544 0.141930
C 3.826918 0.292976 0.083001
C 1.451529 -0.250754 0.083863
C 1.154375 1.141635 -0.031308
C 5.683830 -2.395693 -0.949127
C 3.572589 1.675392 -0.031176
C 2.225929 2.080938 -0.086371
C -1.408220 0.661572 -0.031272
C -0.246311 1.662740 -0.098056
C -2.798255 1.337415 -0.111490
C -3.920516 0.313458 -0.030160
C -4.435980 -0.297184 -1.203212
C -4.453742 -0.083342 1.224032
C -5.451001 -1.277853 -1.127399
C -5.468652 -1.063486 1.306397
C -5.970374 -1.666521 0.129452
H 5.428654 -2.054381 1.190750
H 3.103154 -2.550968 1.209104
H 3.106867 -2.716376 -0.565782
H 0.643993 -0.989156 0.127765
H 5.207115 -2.102168 -1.901021
H 6.735566 -2.063339 -0.968289
H 5.668188 -3.498984 -0.874440
H 4.394629 2.394714 -0.074610
H 1.963978 3.140480 -0.174834
H -1.299867 -0.075777 -0.852773
H -1.327919 0.076521 0.907622
H -2.878433 2.076266 0.706121
H -2.857268 1.913057 -1.052715
H -4.044765 0.006556 -2.182689
H -4.076537 0.387947 2.140709
H -5.840519 -1.732987 -2.045409
H -5.872030 -1.351382 2.284145
H -6.760354 -2.423606 0.190383


