D0D1HA -OEChem-04152108423D 47 49 0 1 0 0 0 0 0999 V2000 -0.9192 0.7594 -1.9256 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6489 -3.3993 0.5783 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0414 0.9728 2.6348 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4499 -0.1403 -1.0739 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1799 0.5502 2.8462 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -1.6306 2.2171 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9402 1.6413 1.6721 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3627 2.5141 -0.9484 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9616 -1.8739 -0.8589 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3678 0.9313 0.6856 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5479 1.3204 -0.1903 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6423 1.1405 -0.9332 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9796 -1.6156 -0.7373 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 -3.8344 -0.9792 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9867 1.7752 -0.4323 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3494 1.9920 0.3114 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3323 1.2460 1.4937 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4744 0.1444 0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1498 -0.1389 -0.4449 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6839 0.3043 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4307 -0.9359 -0.5064 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8681 -0.4387 1.9856 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7135 1.2201 0.5494 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8112 0.4876 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9655 -0.9660 -0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6815 -0.7317 -1.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1423 -1.7656 0.7038 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6579 0.2254 -1.8102 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9095 -2.9018 -0.4744 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3119 3.1478 -1.7919 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6017 2.6793 -0.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 3.0469 0.5335 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2845 1.1572 -2.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -0.5094 -2.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5406 0.9084 -1.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2695 -1.8301 -1.1213 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7589 -1.2669 0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4493 0.2047 3.7239 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2928 -1.4918 1.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7672 1.1038 -1.1693 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6329 -0.2613 -1.9051 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3147 0.5157 -2.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0995 4.2200 -1.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2343 2.7586 -2.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3249 2.9961 -1.4065 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6707 -4.8189 -0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5185 -3.5831 -1.6045 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 20 1 0 0 0 0 2 27 1 0 0 0 0 2 29 1 0 0 0 0 3 17 2 0 0 0 0 4 21 1 0 0 0 0 4 26 1 0 0 0 0 5 22 1 0 0 0 0 5 38 1 0 0 0 0 6 22 2 0 0 0 0 7 23 2 0 0 0 0 8 12 1 0 0 0 0 8 30 1 0 0 0 0 9 26 2 0 0 0 0 10 15 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 11 35 1 0 0 0 0 12 24 2 0 0 0 0 13 25 1 0 0 0 0 13 29 2 0 0 0 0 14 29 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 27 2 0 0 0 0 26 28 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 M END $$$$