BPLX72 -OEChem-04022113513D 78 81 0 1 0 0 0 0 0999 V2000 1.5038 -3.4979 2.0247 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6633 1.3772 -2.1291 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5544 0.8254 -2.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1745 -2.2514 2.3466 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0405 -4.7581 2.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 4.1602 -1.1817 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8821 0.5710 -0.1882 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2318 -3.5808 0.3218 N 0 0 2 0 0 0 0 0 0 0 0 0 3.2630 3.3681 -0.7467 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9174 3.8265 0.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6819 1.8788 -0.7873 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7763 3.0971 1.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0567 1.4279 -0.0603 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1133 2.1252 1.3161 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0473 3.2185 1.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1147 3.6800 -1.7223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6244 2.7703 1.7654 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 3.4521 1.1448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0442 2.0540 2.2783 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3187 0.6225 -0.3182 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6555 -0.0550 -2.2048 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3649 -0.6592 -1.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3218 1.7434 2.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2053 -2.3494 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0185 -0.4759 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0024 1.3819 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2354 0.3540 -1.3937 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3812 -1.8511 -0.9659 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1417 -0.0096 -1.9133 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0054 -1.6532 -0.5418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3787 -4.6933 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3852 -0.7143 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4109 1.2194 -0.9475 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0642 -5.3993 -1.3489 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1614 -3.3606 2.6402 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5438 -1.4541 -0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5696 0.4798 -1.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4015 -6.0134 -0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 -0.8571 -0.7914 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6793 4.9001 0.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8093 3.7328 1.3363 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6849 1.7301 -0.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 1.2919 -0.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9791 2.1937 -0.8434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0783 1.3827 2.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0899 2.6202 1.4097 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3395 3.8204 2.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0803 3.8977 0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4097 3.5138 -2.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7974 4.7266 -1.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2412 3.0513 -1.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 4.2767 0.4691 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2058 4.0203 -0.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2057 5.1543 -1.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0691 1.7570 2.4866 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5415 0.1147 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5206 -0.4403 -1.6523 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7812 -0.3296 -3.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1105 1.2166 3.1972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2226 0.5786 3.6124 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3188 -2.3825 -0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1131 0.9048 -2.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 -2.0233 -0.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6074 -4.3289 -0.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2064 -5.4306 0.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5585 -1.2028 0.5826 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3722 2.2605 -1.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4049 -6.1937 -1.7178 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2185 -4.7033 -2.1815 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1043 -3.3063 3.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6167 -2.4453 2.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7396 -4.2398 2.3558 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5972 -2.4939 0.1476 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4204 0.9447 -1.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1277 -5.2484 -0.6677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 -6.7131 -0.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8218 -6.5649 -1.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5385 -1.4327 -0.9747 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 8 1 0 0 0 0 1 35 1 0 0 0 0 2 11 1 0 0 0 0 2 21 1 0 0 0 0 3 27 2 0 0 0 0 6 9 1 0 0 0 0 6 53 1 0 0 0 0 6 54 1 0 0 0 0 7 13 1 0 0 0 0 7 27 1 0 0 0 0 7 56 1 0 0 0 0 8 24 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 18 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 17 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 52 1 0 0 0 0 19 26 1 0 0 0 0 19 55 1 0 0 0 0 20 32 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 28 1 0 0 0 0 22 29 2 0 0 0 0 23 26 2 0 0 0 0 23 59 1 0 0 0 0 24 28 2 0 0 0 0 24 30 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 25 30 2 0 0 0 0 26 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 31 34 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 36 1 0 0 0 0 32 66 1 0 0 0 0 33 37 2 0 0 0 0 33 67 1 0 0 0 0 34 38 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 36 39 2 0 0 0 0 36 73 1 0 0 0 0 37 39 1 0 0 0 0 37 74 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 39 78 1 0 0 0 0 M END $$$$