B3RA9E -OEChem-04022102302D 45 47 0 1 0 0 0 0 0999 V2000 6.6428 8.6196 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3823 8.4384 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 4.9787 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 5.6573 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.9268 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.9414 7.5618 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7692 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4032 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7692 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0013 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1352 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0047 6.3005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3764 4.9787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5047 7.8393 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0321 6.7151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7102 5.7244 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3291 7.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6897 5.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3137 7.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0094 6.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0047 6.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6957 7.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3148 7.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6814 6.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3197 5.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6803 7.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2992 5.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6587 6.3979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2921 8.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9773 6.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9641 7.3501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2692 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1352 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4478 6.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3169 5.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8515 7.8177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0895 8.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1597 5.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 4.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1826 4.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9834 5.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4921 5.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5181 4.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4814 8.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5382 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 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 32 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 45 1 0 0 0 0 11 33 2 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 12 21 1 0 0 0 0 16 13 1 1 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 19 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 6 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 20 23 1 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 26 2 0 0 0 0 23 29 2 0 0 0 0 24 28 1 0 0 0 0 24 42 1 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 26 30 1 0 0 0 0 27 30 2 0 0 0 0 28 31 2 0 0 0 0 29 31 1 0 0 0 0 29 44 1 0 0 0 0 32 33 1 0 0 0 0 M END $$$$