BTE80V -OEChem-04022105553D 44 47 0 1 0 0 0 0 0999 V2000 5.1778 -1.4539 1.3160 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6568 -2.5380 0.0992 N 0 0 1 0 0 0 0 0 0 0 0 0 -2.2261 3.3492 0.2209 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4241 0.4980 -0.6182 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7303 0.2094 1.7296 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2511 -0.8754 1.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1582 -0.1223 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5531 -2.3698 1.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5074 1.1608 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2831 -2.0254 -1.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6241 -0.6735 -1.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1198 1.4414 -0.1158 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9697 2.8231 0.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1628 2.3507 0.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0711 -3.9369 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0276 0.6526 -0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2755 3.4580 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2797 1.2742 -0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3993 2.6555 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0863 0.0096 0.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.7954 0.0499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7354 -1.0649 -1.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9081 -1.8708 -1.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2594 -2.1562 0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3131 -0.7879 1.8085 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0405 -0.4200 1.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6523 -2.8946 0.7036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8201 -2.7937 2.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1905 -1.9457 -1.8395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6018 -2.7171 -1.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5227 -0.1491 -2.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2093 2.5829 0.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2596 -4.5899 -0.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9157 -4.0471 -0.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4138 -4.2953 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4271 4.3309 0.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0587 -0.4253 -0.4421 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3696 4.5332 0.0614 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3778 3.1274 -0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2913 -0.7289 -2.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9187 0.7554 1.9962 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2767 -0.1905 2.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4658 -2.2234 -1.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0996 -2.7435 0.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 24 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 36 1 0 0 0 0 4 18 1 0 0 0 0 4 20 2 0 0 0 0 5 20 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 37 1 0 0 0 0 17 19 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$