B3QZ1G -OEChem-04012113122D 42 44 0 1 0 0 0 0 0999 V2000 8.1776 -2.8488 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1661 -3.8372 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1778 -2.8257 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8161 0.6325 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -0.7292 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.4544 1.0143 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.6964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 1.1825 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 1.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4804 0.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 3.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3406 -0.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2124 0.1626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3291 -1.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0726 -0.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 -1.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 -1.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1777 -2.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9443 0.1425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0259 0.8674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8712 0.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2617 -0.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8856 3.7309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 3.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0089 2.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6071 3.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 1.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2196 0.7825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7886 -1.6311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5943 -1.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 5 27 1 0 0 0 0 6 27 1 0 0 0 0 7 19 1 0 0 0 0 7 41 1 0 0 0 0 8 22 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 17 2 0 0 0 0 12 16 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 31 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 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 22 1 0 0 0 0 18 37 1 0 0 0 0 19 22 2 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 24 2 0 0 0 0 21 39 1 0 0 0 0 23 25 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$