LD1AB3 -OEChem-05022323093D 34 36 0 0 0 0 0 0 0999 V2000 5.3474 2.4314 -0.0143 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6992 0.0537 -0.0051 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6875 2.4138 -0.0414 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2498 -3.3918 -0.5773 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4492 -2.6026 0.5636 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1731 0.1151 0.0386 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -0.0759 -0.0138 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7829 -0.6922 0.0214 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.3561 0.0254 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8529 -1.3698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5701 0.0816 0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2595 -1.1311 0.0324 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2756 1.2848 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7116 0.2870 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1187 0.9483 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3391 1.2388 0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6543 -1.1405 0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3869 1.6284 -0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6705 1.2756 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 1.9703 -0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3599 0.0628 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1178 0.7738 -0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5385 -1.3518 0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5531 -2.4059 0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2202 -0.0479 -0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7048 -0.7872 0.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8243 2.2659 0.0147 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2219 -2.0672 0.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1045 2.4385 -0.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7574 3.0157 -0.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0619 1.8521 -0.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9097 -2.2323 0.0385 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2598 0.2452 -0.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7681 -4.2462 -0.5615 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 21 1 0 0 0 0 3 16 2 0 0 0 0 4 24 1 0 0 0 0 4 34 1 0 0 0 0 5 24 2 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 14 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 15 2 0 0 0 0 10 23 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 17 2 0 0 0 0 12 24 1 0 0 0 0 13 19 1 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 17 21 1 0 0 0 0 17 28 1 0 0 0 0 18 20 2 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 20 30 1 0 0 0 0 22 25 2 0 0 0 0 22 31 1 0 0 0 0 23 32 1 0 0 0 0 25 33 1 0 0 0 0 M END $$$$