NCI:323748 BBtclserve11129919042D 0 0.00000 0.00000174000 75155-59-8 84 90 0 0 0 0 0 0 0 0 1 V2000 9.7942 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5994 0.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7713 1.8288 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2584 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7104 2.1724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2584 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4775 1.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6244 4.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.6244 2.6340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 3.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4166 1.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3056 0.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3302 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1838 1.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0728 -0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1229 1.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0119 0.2481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 6.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 4.6340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.7943 6.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0620 1.9205 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.7792 2.5159 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 16.4666 0.6377 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.8660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.1339 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1602 -6.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -6.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.1602 -4.6340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -4.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -2.6340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 2 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 9 16 2 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 13 20 2 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 17 24 1 0 0 0 0 18 25 1 0 0 0 0 19 26 1 0 0 0 0 19 27 2 0 0 0 0 21 28 1 0 0 0 0 22 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 26 33 1 0 0 0 0 26 34 1 0 0 0 0 26 35 1 0 0 0 0 28 36 2 0 0 0 0 28 37 1 0 0 0 0 29 38 1 0 0 0 0 30 39 1 0 0 0 0 31 40 2 0 0 0 0 31 41 1 0 0 0 0 32 42 1 0 0 0 0 36 43 1 0 0 0 0 37 44 2 0 0 0 0 38 45 2 0 0 0 0 38 46 1 0 0 0 0 39 47 1 0 0 0 0 40 48 1 0 0 0 0 41 49 2 0 0 0 0 42 50 2 0 0 0 0 42 51 1 0 0 0 0 43 52 1 0 0 0 0 43 53 2 0 0 0 0 45 54 1 0 0 0 0 46 55 2 0 0 0 0 47 56 2 0 0 0 0 47 57 1 0 0 0 0 48 58 1 0 0 0 0 48 59 2 0 0 0 0 50 60 1 0 0 0 0 51 61 2 0 0 0 0 52 62 1 0 0 0 0 52 63 1 0 0 0 0 52 64 1 0 0 0 0 54 65 1 0 0 0 0 54 66 2 0 0 0 0 56 67 1 0 0 0 0 57 68 2 0 0 0 0 58 69 1 0 0 0 0 58 70 1 0 0 0 0 58 71 1 0 0 0 0 60 72 1 0 0 0 0 60 73 2 0 0 0 0 65 74 1 0 0 0 0 65 75 1 0 0 0 0 65 76 1 0 0 0 0 67 77 1 0 0 0 0 67 78 2 0 0 0 0 72 79 1 0 0 0 0 72 80 1 0 0 0 0 72 81 1 0 0 0 0 77 82 1 0 0 0 0 77 83 1 0 0 0 0 77 84 1 0 0 0 0 11 16 1 0 0 0 0 20 27 1 0 0 0 0 44 53 1 0 0 0 0 49 59 1 0 0 0 0 55 66 1 0 0 0 0 61 73 1 0 0 0 0 68 78 1 0 0 0 0 M END