BR0VI3 -OEChem-04022103503D 58 61 0 0 0 0 0 0 0999 V2000 -5.7147 -0.2088 0.2567 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3991 -0.0353 -1.6042 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1991 1.4574 -0.2081 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8571 1.1549 0.3329 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4407 -0.3256 0.2539 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8586 -1.9890 0.5311 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2734 -3.0189 0.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1077 0.6249 -0.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4082 0.3148 -0.7155 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6934 0.4358 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4592 0.9533 -0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6703 1.7859 -0.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1084 -0.6632 0.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0968 0.3554 -0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6307 -0.9185 0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5688 -1.1141 -0.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5046 -1.8843 0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0829 2.8356 -0.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2028 1.4788 1.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9146 1.4652 -0.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6379 0.2754 -0.4385 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0168 -1.0366 0.2322 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8453 0.0560 -0.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2952 1.3052 -0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1421 -0.3898 -1.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6873 -1.5322 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7441 -2.3276 -0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 2.6872 1.7916 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2782 -0.1148 -0.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0926 -0.9683 0.6412 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3926 -0.6590 0.1985 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5641 2.7590 0.2898 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8333 1.9692 -1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6605 2.8542 -1.4696 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8281 3.4069 -0.7197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6264 3.2899 0.2897 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6965 0.6221 2.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2808 1.6577 2.2811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 2.4546 -0.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4536 -2.0132 0.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9153 2.1725 -0.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0006 -0.9406 -2.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4464 -0.2794 -2.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4855 0.6160 -1.4005 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3873 -2.2287 0.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2753 -2.0097 1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2494 -0.6572 0.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1059 -2.1624 -1.7503 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4035 -3.1598 -1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0963 -2.6689 -0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6359 3.5723 1.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0469 2.5137 1.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3628 2.9113 2.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2823 -2.9553 0.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1885 -3.8977 1.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 -1.7077 1.3735 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8631 1.3501 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3293 -1.1022 0.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 21 1 0 0 0 0 2 21 2 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 4 12 1 0 0 0 0 4 19 1 0 0 0 0 4 21 1 0 0 0 0 5 11 2 0 0 0 0 5 13 1 0 0 0 0 6 15 1 0 0 0 0 6 17 2 0 0 0 0 7 17 1 0 0 0 0 7 54 1 0 0 0 0 7 55 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 57 1 0 0 0 0 9 31 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 22 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 28 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 24 2 0 0 0 0 20 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$