NCI:697162 BBtclserve11129920282D 0 0.00000 0.00000247404 Corina 01.500030 20.12.1994 46 51 0 0 0 0 0 0 0 0 1 V2000 15.6331 0.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0453 -0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0508 -0.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4630 -0.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4685 -0.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6276 0.5601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1276 -0.3059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1058 -0.0980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2103 0.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2968 1.3032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.0764 1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9424 0.8965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8807 -1.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8862 -1.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2984 -2.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3039 -2.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8039 -1.2873 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8257 -1.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7212 -2.4897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6348 -2.8965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 -0.8261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1315 -1.1351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8084 1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6744 0.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5405 1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5405 2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6744 2.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8084 2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 -0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5963 0.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 1.1813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 0.8723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -0.1058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4373 -0.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2106 -0.3738 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0889 2.2814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.4065 0.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2725 1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2725 2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4065 2.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 1.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 -0.4149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6744 -0.1035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 -1.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 11 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 41 1 0 0 0 0 33 44 1 0 0 0 0 33 34 1 0 0 0 0 34 46 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 M END