BA7TU0 -OEChem-04022106133D 32 32 0 0 0 0 0 0 0999 V2000 -2.1736 -1.6533 -0.7196 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0717 -0.2428 0.5466 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6928 1.6164 -0.7568 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1291 1.4742 1.0562 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4317 0.3687 -0.6369 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4714 -1.8542 -0.4113 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 2.2545 -0.5807 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8867 0.0796 0.5583 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1801 -0.3149 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6662 -0.6558 -0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9377 0.0538 -0.3528 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8236 0.8501 -0.5225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.9699 -0.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6988 -1.3045 -0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2914 0.5706 -0.2291 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 0.4239 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4307 0.1615 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1254 -0.8579 1.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0232 0.6038 -0.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -0.1248 1.0171 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8417 -1.5769 0.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0063 -0.8299 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4964 -2.0314 -0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9366 0.2236 -0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4506 1.1440 1.2292 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1688 -0.5796 1.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -0.9439 2.5889 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0955 -1.8494 1.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7671 2.6675 -0.0605 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1673 2.8121 -0.7097 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2139 -0.7985 0.1681 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5934 0.7042 0.9325 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 2 17 1 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 5 12 2 0 0 0 0 5 13 1 0 0 0 0 6 13 2 0 0 0 0 6 14 1 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 16 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 16 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 14 23 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 M END $$$$