BO3E4T -OEChem-04022106442D 42 44 0 1 0 0 0 0 0999 V2000 4.4026 -0.7111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9405 -0.2067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 -1.7948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7066 -2.6802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.0495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.8542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9405 -0.2084 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9422 -1.2084 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 -1.5191 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9889 0.0990 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6844 -2.4706 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2479 0.7432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3548 -3.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0474 -4.1642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -0.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5938 -2.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 0.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2687 -2.0106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8379 0.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4385 1.3332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6579 0.9338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9027 -3.5028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7356 -2.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2496 0.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6886 -2.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 1.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -3.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 3.2483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4574 -3.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8568 -4.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6374 -4.3548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 4.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 9 2 1 6 0 0 0 2 32 1 0 0 0 0 10 3 1 6 0 0 0 3 33 1 0 0 0 0 13 4 1 1 0 0 0 4 35 1 0 0 0 0 12 5 1 1 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 16 2 0 0 0 0 6 22 1 0 0 0 0 7 21 1 0 0 0 0 7 22 2 0 0 0 0 8 21 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 6 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 20 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$