BR82KT -OEChem-04012114253D 63 67 0 1 0 0 0 0 0999 V2000 7.6100 2.7101 -0.2534 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0796 1.3870 1.3997 F 0 0 0 0 0 0 0 0 0 0 0 0 8.4602 0.7470 -0.6434 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4992 3.1450 -1.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5902 -2.4099 1.5233 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3555 -1.1635 -0.2779 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1339 -2.2224 -0.0935 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4101 -0.9248 -0.1533 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7449 -1.1044 0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6385 -0.2099 -0.5165 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9759 0.8026 1.0942 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8321 2.1574 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3675 1.6229 1.0662 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4378 -0.5029 0.4111 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2726 0.8631 -1.5595 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6144 1.8630 0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7963 0.3276 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1399 1.3383 1.9524 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9903 2.6774 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5102 -2.0743 0.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4472 -2.6100 -0.6072 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5463 -4.1269 -0.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9304 -2.7158 -0.9763 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0408 -0.7628 0.0332 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 -2.3655 -0.4193 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -0.3467 0.6231 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6862 -0.3554 -0.0783 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8447 0.9844 -0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1067 1.5640 -0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9564 -0.5068 0.4141 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 0.8110 0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5504 1.4012 0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9552 -1.1259 -1.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1061 0.6141 1.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1922 1.9946 1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7745 -1.1971 1.1933 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1336 1.0638 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4814 0.5104 -2.2321 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 1.5308 -0.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 2.7865 0.5254 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6748 0.5210 -0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -0.4268 1.0886 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4005 0.6082 2.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8317 2.2552 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7045 3.6195 0.4991 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8587 2.9189 -0.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1739 -0.9015 -1.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2831 3.3008 -2.3749 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6054 -2.1947 -1.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0122 -4.5229 -1.5792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -4.4314 -0.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1711 -4.6250 0.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9157 -3.8064 -1.0661 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8242 -2.2982 -1.9867 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1784 -0.2783 -0.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8028 -0.3593 0.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5008 -2.9238 0.5067 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -2.6725 -1.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3868 -0.6839 1.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3552 0.7482 0.6345 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0068 1.5737 -0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2304 2.6012 -0.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7614 -1.1436 0.7677 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 32 1 0 0 0 0 3 32 1 0 0 0 0 4 12 1 0 0 0 0 4 48 1 0 0 0 0 5 20 2 0 0 0 0 6 14 1 0 0 0 0 6 20 1 0 0 0 0 6 47 1 0 0 0 0 7 21 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 27 2 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 17 1 0 0 0 0 10 33 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 11 18 1 0 0 0 0 11 34 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 25 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 26 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 61 1 0 0 0 0 29 31 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 M END $$$$