BVCR27 -OEChem-04022109472D 60 60 0 1 0 0 0 0 0999 V2000 8.3594 6.7145 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 3.6200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 12.4491 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4444 3.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4444 3.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4124 3.9206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7579 7.9859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8987 5.2589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 10.3085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 4.6200 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.3566 6.9679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9476 5.5679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5823 9.6040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8135 12.1355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9444 6.1588 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2534 5.2078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9444 6.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6354 5.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2045 4.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7634 7.8814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1756 8.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5784 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3104 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5784 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3104 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9945 10.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4013 11.3265 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3958 11.4311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8025 12.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2038 13.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2259 6.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3504 4.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5509 6.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 6.7754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 5.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3254 4.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 6.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8187 6.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6616 9.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7449 8.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8474 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1989 9.6688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8474 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3594 5.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6534 11.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3525 10.8126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9974 11.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 12.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2009 12.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0656 12.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1969 12.0707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7702 13.1105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4559 13.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6374 13.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3594 6.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 60 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 10 1 0 0 0 0 2 20 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 6 19 2 0 0 0 0 7 21 2 0 0 0 0 8 12 1 0 0 0 0 8 49 1 0 0 0 0 9 28 2 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 15 11 1 1 0 0 0 11 21 1 0 0 0 0 11 39 1 0 0 0 0 12 19 1 0 0 0 0 12 40 1 0 0 0 0 13 22 1 0 0 0 0 13 28 1 0 0 0 0 13 45 1 0 0 0 0 29 14 1 1 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 1 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 27 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END $$$$