BCR4P5 -OEChem-04042101433D 73 77 0 0 0 0 0 0 0999 V2000 -7.8244 1.2778 0.5036 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5503 -2.4982 -2.1641 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 0.9616 2.9301 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6800 1.8419 -0.8249 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7373 2.1323 1.6723 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.3188 -1.3621 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7403 -0.0184 0.6874 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3921 0.3043 -2.5724 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9794 0.8650 -2.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9464 -0.2182 -2.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2633 0.4668 -0.2814 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5436 0.3769 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4849 -0.6987 -1.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7036 -0.0655 0.8749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8931 -0.1089 -1.5194 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2999 1.9329 -0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9138 -1.1798 -1.1281 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7801 -1.5037 1.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8929 -1.7372 -1.2602 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7815 2.2702 1.0813 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3787 -2.3340 0.0177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3307 -0.6292 -0.9375 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0555 1.0352 1.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3346 -1.6880 -0.4691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9704 2.9687 -1.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2309 -2.0923 2.2632 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 3.5679 1.5334 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7428 -1.1282 -0.2905 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4295 -3.7284 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1311 4.2974 -0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6189 4.5948 0.6577 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2805 -3.4822 2.3933 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8808 -4.2985 1.3393 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3881 0.4569 0.5799 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0262 0.2851 1.8083 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9819 -0.0224 -0.5876 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2582 -0.3660 1.8692 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2139 -0.6736 -0.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8521 -0.8455 0.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1222 1.0437 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3797 -0.4431 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7075 1.3533 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8975 1.6213 -1.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -0.9794 -2.9066 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -0.7203 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2587 0.8643 -2.9193 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5451 1.1503 -1.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4742 -1.4850 -2.3899 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2092 -1.1690 -0.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1818 0.3408 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8992 0.6922 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9321 -1.9636 -1.8953 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5918 -1.6582 -0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6768 -0.1940 -1.8832 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2882 0.1892 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3661 -2.5107 -1.1933 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9894 -2.1113 0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6253 2.8347 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5515 -1.4919 3.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3315 3.7830 2.5259 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4081 -1.9176 0.0738 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1131 -0.7836 -1.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1226 -4.3861 -0.6578 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8815 5.1094 -1.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7371 5.6304 0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6322 -3.9266 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9204 -5.3789 1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4124 -0.2560 1.6319 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5784 0.6432 2.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5022 0.0982 -1.5546 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7544 -0.5016 2.8258 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6761 -1.0476 -1.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8111 -1.3531 0.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 7 1 0 0 0 0 1 34 1 0 0 0 0 2 19 2 0 0 0 0 3 23 2 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 19 1 0 0 0 0 7 28 1 0 0 0 0 7 68 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 12 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 14 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 15 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 15 17 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 20 1 0 0 0 0 16 25 2 0 0 0 0 17 22 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 21 1 0 0 0 0 18 26 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 27 2 0 0 0 0 21 29 2 0 0 0 0 22 24 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 24 28 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 30 1 0 0 0 0 25 58 1 0 0 0 0 26 32 1 0 0 0 0 26 59 1 0 0 0 0 27 31 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 33 1 0 0 0 0 29 63 1 0 0 0 0 30 31 2 0 0 0 0 30 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 2 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 35 69 1 0 0 0 0 36 38 2 0 0 0 0 36 70 1 0 0 0 0 37 39 2 0 0 0 0 37 71 1 0 0 0 0 38 39 1 0 0 0 0 38 72 1 0 0 0 0 39 73 1 0 0 0 0 M END $$$$