B5LPA4 -OEChem-04042107433D 36 38 0 0 0 0 0 0 0999 V2000 -0.4252 -1.2110 -0.9413 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 1.9322 1.2652 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4492 -0.3830 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3274 -2.6116 -1.3247 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2402 -0.1721 -1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6158 -0.9257 0.3951 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8164 -0.1386 -1.1487 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9934 -0.9532 -0.2013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4219 0.3138 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0239 -0.6232 0.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0393 -0.5539 0.9513 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8208 -2.0600 -0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5917 1.4832 0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6776 0.4740 0.7804 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1462 -0.2461 0.1415 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0767 -1.8999 0.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -0.6329 0.9701 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0095 -0.7494 2.4107 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 2.3407 -1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5453 -0.0448 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5747 3.3820 -0.8548 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0478 3.2795 0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4698 -1.4413 1.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5188 -3.0608 -0.3048 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0297 1.4538 1.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 -2.7615 0.7228 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4828 -0.5084 1.4262 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9001 -1.8119 2.6512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -0.2088 2.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 -0.3882 2.8887 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1264 2.2346 -1.9553 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2076 0.1013 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6322 0.8374 1.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9119 -0.9128 1.1116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 4.1662 -1.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8059 3.9308 0.7813 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 6 1 0 0 0 0 1 8 1 0 0 0 0 2 13 1 0 0 0 0 2 22 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 15 1 0 0 0 0 11 18 1 0 0 0 0 12 16 1 0 0 0 0 12 24 1 0 0 0 0 13 19 2 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 21 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$