B7OTS6 -OEChem-04042101543D 39 41 0 0 0 0 0 0 0999 V2000 2.8027 -1.7232 0.2135 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4432 0.8316 -0.0763 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8493 -2.6175 0.0625 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0602 0.7233 -0.0015 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2467 0.6178 0.0705 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6071 0.4846 0.1449 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9611 3.4836 -0.1163 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0073 -1.5701 0.0413 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0738 -1.2944 0.2626 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1628 2.7468 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1235 1.3464 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1815 1.4650 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8305 -0.5208 -0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4388 1.2525 0.0783 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4076 3.3656 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5738 2.6199 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1875 -0.8950 -0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1332 2.8298 -0.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1663 -2.2670 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5026 -2.6722 0.3329 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7287 -0.9155 0.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3223 -3.9590 0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4744 -3.3321 -1.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 1.5102 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4762 4.4504 -0.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5399 3.1122 0.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0638 -0.2651 -0.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0167 3.4545 -0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9603 -3.0010 0.0165 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4801 1.0065 0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5187 -2.6799 0.7392 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 -3.2113 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7856 -0.5707 0.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1472 -4.6757 0.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -4.0484 1.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -4.1290 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4621 -3.3437 -1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1184 -2.7979 -1.7369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8258 -4.3661 -0.9608 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 2 24 1 0 0 0 0 3 8 1 0 0 0 0 3 19 1 0 0 0 0 3 22 1 0 0 0 0 4 11 2 0 0 0 0 4 12 1 0 0 0 0 5 11 1 0 0 0 0 5 14 2 0 0 0 0 6 14 1 0 0 0 0 6 21 1 0 0 0 0 6 30 1 0 0 0 0 7 10 2 0 0 0 0 7 18 1 0 0 0 0 8 13 2 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 12 18 2 0 0 0 0 13 17 1 0 0 0 0 14 16 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 20 23 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$