BJAF95 -OEChem-04022107113D 62 65 0 1 0 0 0 0 0999 V2000 -0.4561 -0.0955 -0.9443 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.4577 0.2135 0.6398 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8561 -0.8548 -1.1818 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1689 1.0866 -1.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3619 0.7277 -2.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0163 -0.8466 -0.4867 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0365 -0.3923 -1.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7758 -1.3997 -1.0523 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4264 -1.5529 0.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4964 -2.5847 -0.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4379 -2.6656 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0419 0.5291 -0.4710 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7337 0.1556 -1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4124 2.0075 -0.7176 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5281 -3.5082 -0.2928 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3771 -3.6732 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8004 2.3116 -0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3478 2.9959 -0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 -4.5305 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3485 -4.6123 1.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8492 2.1681 1.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2469 1.1534 1.2464 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0947 -0.2751 -1.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1353 2.4897 0.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2045 -1.0109 -0.7863 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 0.7635 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 1.0461 -1.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9391 3.4473 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4677 -0.4196 -0.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9567 1.7211 2.8457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4995 1.6374 -1.6124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8497 3.0630 2.4801 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6151 0.9046 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9561 -1.6944 -2.0912 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4422 -1.9406 0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3444 -0.8654 1.5856 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9626 0.3826 0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5065 2.1720 -1.8008 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2567 -3.4559 -1.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1055 -3.7373 2.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0759 3.3425 -0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 1.6770 -0.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4313 2.9284 -0.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0765 2.8040 0.8231 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7077 4.0274 -0.2968 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -5.2717 0.5933 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 -1.3590 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1609 -0.2353 -2.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2771 -5.4153 2.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6939 1.1349 1.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1138 2.8061 1.9025 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8379 2.4702 1.7676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4186 2.8068 0.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0936 -2.0420 -0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2401 -0.2808 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4074 1.6478 -1.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8531 4.4926 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3365 -0.9900 -0.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6664 1.4217 3.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6156 2.6669 -1.9384 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4752 3.8086 2.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5989 1.3648 -1.2153 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 8 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 5 13 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 7 12 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 38 1 0 0 0 0 15 19 1 0 0 0 0 15 39 1 0 0 0 0 16 20 1 0 0 0 0 16 40 1 0 0 0 0 17 21 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 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 24 2 0 0 0 0 22 26 1 0 0 0 0 23 25 2 0 0 0 0 23 27 1 0 0 0 0 24 28 1 0 0 0 0 24 53 1 0 0 0 0 25 29 1 0 0 0 0 25 54 1 0 0 0 0 26 30 2 0 0 0 0 26 55 1 0 0 0 0 27 31 2 0 0 0 0 27 56 1 0 0 0 0 28 32 2 0 0 0 0 28 57 1 0 0 0 0 29 33 2 0 0 0 0 29 58 1 0 0 0 0 30 32 1 0 0 0 0 30 59 1 0 0 0 0 31 33 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M END $$$$