BMR12K -OEChem-04022101122D 69 74 0 1 0 0 0 0 0999 V2000 6.6440 5.7411 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7202 0.2849 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3581 -2.1771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -4.8751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5636 -2.8141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -5.7411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2257 -0.6857 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.7980 -2.9407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -4.0091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 1.0939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4891 -1.6683 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0902 -2.1771 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7479 -2.6342 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3490 -3.1430 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5224 -1.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9689 -3.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2241 -1.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -4.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7257 0.1803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0256 -4.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7411 -3.3828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9582 -5.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8218 -4.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -4.8751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0621 1.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9282 1.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -4.8751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9576 2.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8417 1.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7666 3.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0441 3.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9462 2.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6507 1.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6621 4.3398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9395 4.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8598 3.0710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5643 1.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -5.7411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 4.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6688 2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2691 -0.8473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5983 -2.5545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9679 -3.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7475 -3.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5274 -1.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1367 -1.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8256 -1.2022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6227 -1.2022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5076 -4.8807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -3.4721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9991 -5.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8212 -1.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3801 -4.6910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9316 -5.0871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2413 -5.4857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7664 -4.6630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4566 -4.2645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 3.0932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5425 2.7999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4446 3.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5859 0.4654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1637 4.7043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3731 4.4110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9246 3.6876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0658 1.1243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -6.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.7411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -5.1211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2352 2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 39 1 0 0 0 0 2 19 1 0 0 0 0 2 26 1 0 0 0 0 3 17 1 0 0 0 0 3 52 1 0 0 0 0 4 18 2 0 0 0 0 5 21 2 0 0 0 0 6 27 1 0 0 0 0 6 38 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 21 1 0 0 0 0 9 18 1 0 0 0 0 9 24 1 0 0 0 0 9 50 1 0 0 0 0 10 19 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 41 1 6 0 0 0 12 14 1 0 0 0 0 12 17 1 1 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 1 0 0 0 14 18 1 6 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 20 2 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 20 22 1 0 0 0 0 20 49 1 0 0 0 0 21 23 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 53 1 0 0 0 0 24 27 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 32 2 0 0 0 0 29 33 1 0 0 0 0 30 34 1 0 0 0 0 30 58 1 0 0 0 0 31 35 2 0 0 0 0 31 59 1 0 0 0 0 32 36 1 0 0 0 0 32 60 1 0 0 0 0 33 37 2 0 0 0 0 33 61 1 0 0 0 0 34 39 2 0 0 0 0 34 62 1 0 0 0 0 35 39 1 0 0 0 0 35 63 1 0 0 0 0 36 40 2 0 0 0 0 36 64 1 0 0 0 0 37 40 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 40 69 1 0 0 0 0 M END $$$$