B98DCM -OEChem-04022102302D 55 57 0 1 0 0 0 0 0999 V2000 8.8980 8.6183 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5860 5.6560 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.1967 7.5605 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8969 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5308 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8969 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9499 7.8777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1289 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2629 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 6.2992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6317 4.9774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 7.8380 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 6.1849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2873 6.7138 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9655 5.7232 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5844 7.4825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9450 5.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 7.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2647 6.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 6.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 7.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 5.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 7.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9367 6.1849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9356 7.4825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2326 6.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5545 5.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9140 6.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5474 8.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2194 7.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2553 6.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 6.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8886 5.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3969 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2629 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7031 6.2539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5722 5.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1068 7.8164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3448 8.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 5.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1713 4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4378 4.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2387 5.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7734 4.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7474 5.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 8.0743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1414 5.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7367 8.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7372 7.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4747 5.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2982 5.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 4.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 5.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6658 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 28 1 0 0 0 0 3 30 1 0 0 0 0 4 34 1 0 0 0 0 5 34 1 0 0 0 0 6 34 1 0 0 0 0 7 31 2 0 0 0 0 8 35 1 0 0 0 0 8 55 1 0 0 0 0 9 35 2 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 20 1 0 0 0 0 15 11 1 1 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 18 2 0 0 0 0 12 21 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 6 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 18 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 23 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 25 1 0 0 0 0 22 27 2 0 0 0 0 22 44 1 0 0 0 0 23 29 2 0 0 0 0 24 28 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 M END $$$$