B3TE1S -OEChem-04022105363D 38 41 0 0 0 0 0 0 0999 V2000 2.9111 2.4618 -0.5688 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5286 -1.8645 1.0751 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -1.3714 -1.5345 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6695 0.6626 0.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7989 -0.0244 -0.2221 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 0.8531 -0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 0.0710 -0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7482 1.2565 -0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6247 1.7761 -0.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9742 -0.4609 0.2802 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6968 -0.3348 -0.0545 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0804 0.8430 1.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 1.2186 0.6122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9636 1.3851 -0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3132 -0.8519 0.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2325 2.2510 -0.8505 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8782 -0.2597 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4612 -0.2232 1.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2717 -0.8360 -1.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8006 -0.6126 1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6111 -1.2253 -1.2288 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3756 -1.1136 -0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3063 -1.2446 -0.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7429 -2.3557 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8219 0.5385 2.3543 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7391 1.7134 1.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3981 2.8130 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2165 -1.1995 0.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7272 2.1180 -0.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5643 -1.8805 0.5227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7254 2.8499 -1.5942 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0288 0.1658 2.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6902 -0.9294 -2.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3960 -0.5256 2.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0589 -1.6154 -2.1381 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4185 -1.4167 -0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9767 -3.3994 -0.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5565 -0.4854 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 17 1 0 0 0 0 2 24 1 0 0 0 0 3 23 1 0 0 0 0 3 38 1 0 0 0 0 4 8 1 0 0 0 0 4 13 2 0 0 0 0 5 17 2 0 0 0 0 5 23 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 16 2 0 0 0 0 9 14 1 0 0 0 0 9 27 1 0 0 0 0 10 15 2 0 0 0 0 10 28 1 0 0 0 0 11 18 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 24 37 1 0 0 0 0 M END $$$$