NCI:658942 BBtclserve11129920082D 0 0.00000 0.00000230386 999-99-9 73 86 0 0 0 0 0 0 0 0 2 V2000 11.2743 -3.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3607 -2.6427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2562 -1.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0652 -1.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9788 -1.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0833 -2.4616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0531 -1.0642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7562 -0.1093 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7562 -0.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3595 -4.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1648 -3.8467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 -2.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1378 -2.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3326 -3.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4434 -4.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0414 -2.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6209 -1.8889 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5839 -1.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9429 4.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7519 4.1220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6474 3.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7338 2.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9248 3.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0294 4.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3165 2.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9982 0.6601 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0953 0.2303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3257 1.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6186 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6527 2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3939 1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1010 0.5524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0669 0.8112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8208 2.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0841 3.9668 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.5619 2.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9902 0.5335 0.0000 Zn 0 2 0 0 0 0 0 0 0 0 0 0 9.7867 -2.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5681 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2562 2.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5223 0.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1222 4.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2562 3.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3902 4.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3902 5.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2562 5.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1222 5.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6167 -4.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0940 -5.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0943 -5.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6175 -4.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1402 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1399 -3.7634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6042 -0.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8915 -1.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9277 -0.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6765 0.1800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3892 0.8814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3531 0.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1203 -0.9665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1203 0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2543 0.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3883 0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3883 -0.9665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2543 -1.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9864 -1.4665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9864 -2.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7127 0.4464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2562 6.7263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1222 7.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5709 -6.3738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0481 -7.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 1 6 2 0 0 0 0 3 7 1 0 0 0 0 7 8 1 0 0 0 0 4 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 10 15 1 0 0 0 0 12 16 2 0 0 0 0 16 17 1 0 0 0 0 13 18 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 19 24 1 0 0 0 0 21 25 1 0 0 0 0 25 26 2 0 0 0 0 22 27 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 28 33 1 0 0 0 0 30 34 1 0 0 0 0 34 35 1 0 0 0 0 31 36 1 0 0 0 0 8 37 1 0 0 0 0 7 38 2 0 0 0 0 18 39 1 0 0 0 0 25 40 1 0 0 0 0 9 41 1 0 0 0 0 40 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 42 47 1 0 0 0 0 48 49 2 0 0 0 0 49 50 1 0 0 0 0 50 51 2 0 0 0 0 38 52 1 0 0 0 0 48 53 1 0 0 0 0 39 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 2 0 0 0 0 54 59 2 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 41 63 1 0 0 0 0 63 64 1 0 0 0 0 60 65 1 0 0 0 0 60 66 1 0 0 0 0 66 67 1 0 0 0 0 57 68 1 0 0 0 0 68 69 1 0 0 0 0 46 70 1 0 0 0 0 70 71 1 0 0 0 0 49 72 1 0 0 0 0 72 73 1 0 0 0 0 5 6 1 0 0 0 0 8 9 2 0 0 0 0 14 15 2 0 0 0 0 17 18 1 0 0 0 0 23 24 2 0 0 0 0 26 27 1 0 0 0 0 32 33 2 0 0 0 0 35 36 1 0 0 0 0 26 37 1 0 0 0 0 16 38 1 0 0 0 0 27 39 2 0 0 0 0 34 40 2 0 0 0 0 36 41 2 0 0 0 0 42 43 2 0 0 0 0 46 47 2 0 0 0 0 51 52 1 0 0 0 0 52 53 2 0 0 0 0 58 59 1 0 0 0 0 62 63 2 0 0 0 0 64 65 2 0 0 0 0 M CHG 5 8 1 17 1 26 1 35 1 37 2 M END