D04AEQ -OEChem-04152112573D 51 55 0 1 0 0 0 0 0999 V2000 -2.3717 -4.0141 1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9269 -1.5310 0.5639 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6305 -1.1581 0.0313 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1556 2.4933 -0.4869 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7763 1.3005 -0.6032 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9622 3.1627 0.3577 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0455 2.4149 0.5603 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2016 0.3644 -1.6647 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2617 -0.8481 -1.1608 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6396 -1.7362 -2.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9347 -2.8420 0.0094 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6807 -3.0680 -0.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -3.8517 1.1282 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6611 -3.3832 0.2771 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3234 -0.5594 -0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8438 0.7910 0.0515 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 3.0847 -0.9184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3487 2.5175 -0.1988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7019 1.3002 -0.8463 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5002 1.4378 1.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9064 1.2677 -0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9353 3.2452 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7015 0.1425 -0.3464 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 2.6879 1.4738 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9669 -0.0036 0.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0571 -0.6781 -1.7603 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6946 0.7810 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7948 -1.1101 0.7304 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8818 0.0626 1.4443 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -2.2704 0.5906 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8621 -3.0032 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3489 -2.2350 -1.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8124 -3.9479 -1.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2535 -3.5376 2.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1771 -4.8304 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8668 -4.0453 -0.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2025 -2.4692 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4169 -0.5618 -0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9213 -0.7698 -1.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2343 2.8829 -1.9942 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 4.1682 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3539 0.9934 1.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5618 4.2192 1.1213 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 3.2266 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4228 1.7505 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6972 0.3642 2.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5959 -2.1440 1.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9805 -2.4051 -0.4548 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1846 -3.1829 0.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2517 -1.6730 -3.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2334 -2.5465 -2.7102 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 11 1 0 0 0 0 2 15 1 0 0 0 0 3 25 1 0 0 0 0 3 28 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 4 19 1 0 0 0 0 5 16 1 0 0 0 0 5 18 2 0 0 0 0 6 7 2 0 0 0 0 7 21 1 0 0 0 0 8 19 2 0 0 0 0 8 26 1 0 0 0 0 9 23 1 0 0 0 0 9 26 2 0 0 0 0 10 26 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 22 1 0 0 0 0 19 21 1 0 0 0 0 20 24 1 0 0 0 0 20 42 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 22 43 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 27 2 0 0 0 0 27 29 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M END $$$$