B4P6MD -OEChem-04022115163D 39 42 0 0 0 0 0 0 0999 V2000 -7.1854 -1.9769 -0.1494 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0879 2.9644 0.3034 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1219 -0.4196 -2.0123 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8829 4.2944 -0.2394 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6078 2.8077 1.6482 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0301 2.0754 -0.8105 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 0.0554 0.5227 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5274 2.1327 0.2276 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9325 0.8224 0.1077 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2635 1.0649 1.0854 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4386 2.5454 -0.6901 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9663 0.4097 1.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6684 1.8901 -0.7501 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2086 0.1433 0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0783 0.6261 -0.6593 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 -1.7768 -0.9495 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1392 -1.3228 0.3727 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2952 -1.2090 0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3519 0.8402 -0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2116 -3.1445 -1.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1658 -2.2738 1.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5249 -1.8644 0.3168 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5816 0.1848 -0.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2372 -4.0646 -0.2121 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2147 -3.6370 1.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6681 -1.1674 -0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9838 0.7449 1.8319 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2488 3.3652 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1401 -0.3926 1.7373 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3771 2.2255 -1.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 2.4079 -1.7816 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4274 -1.7999 0.6571 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3387 1.9005 -0.5818 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2293 -3.4856 -2.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1479 -1.9505 2.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5768 -2.9201 0.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4657 0.7416 -0.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2751 -5.1280 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2349 -4.3671 1.9153 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 6 15 1 0 0 0 0 6 31 1 0 0 0 0 7 15 2 0 0 0 0 7 17 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 11 13 2 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 32 1 0 0 0 0 19 23 2 0 0 0 0 19 33 1 0 0 0 0 20 24 1 0 0 0 0 20 34 1 0 0 0 0 21 25 1 0 0 0 0 21 35 1 0 0 0 0 22 26 2 0 0 0 0 22 36 1 0 0 0 0 23 26 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$