NCI:137054 BBtclserve11129917442D 0 0.00000 0.00000103581 29068-85-7 117132 0 0 0 0 0 0 0 0 1 V2000 17.2113 3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2113 2.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0773 3.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2113 1.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3453 3.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9433 2.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0773 4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0773 1.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3453 1.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4792 2.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8094 3.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9433 1.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9433 4.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4792 1.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8094 4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7604 2.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6132 1.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8094 5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7604 4.3590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3482 3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7472 1.5500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 21.0694 5.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2472 0.6839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8812 2.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2472 2.4160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0476 5.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4003 6.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7472 -0.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8812 3.0500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 22.3566 6.4690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2472 -1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7472 -0.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8812 4.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8812 3.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8812 3.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3347 6.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7472 -1.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2472 -1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0151 4.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3812 2.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6437 7.6280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7472 -1.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2472 -2.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0151 5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1491 4.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8812 1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3812 2.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6219 7.8359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9746 8.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7472 -1.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2472 -2.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7472 -3.6462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1491 6.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2831 4.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3812 0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8812 1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7472 -3.6462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2472 -2.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2831 5.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1491 7.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3812 0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8812 -0.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2472 -4.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7472 -3.6462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 5.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 6.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2831 7.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3812 0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8812 -0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3812 -1.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2472 -4.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9382 -5.4633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 7.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 5.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3812 -1.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8812 -0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2472 -4.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5562 -5.4633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7472 -6.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 7.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6850 6.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8812 -2.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3812 -1.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5073 -5.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6850 7.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3431 8.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8812 -2.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1902 -3.0973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7152 -6.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2504 -5.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 6.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9418 7.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3486 8.6326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8812 -2.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5722 -3.0973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3812 -3.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6663 -7.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9637 7.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6211 -3.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8742 -8.0376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2946 8.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6547 6.5601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4132 -4.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 -2.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8252 -8.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3164 8.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4621 -4.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0332 -9.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5684 -7.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 8.7895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -5.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 8.5816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3032 -5.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 9.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 7.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0953 -6.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -5.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 8 2 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 9 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 19 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 25 2 0 0 0 0 22 26 1 0 0 0 0 22 27 1 0 0 0 0 23 28 1 0 0 0 0 24 29 1 0 0 0 0 26 30 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 29 35 2 0 0 0 0 30 36 1 0 0 0 0 31 37 1 0 0 0 0 32 38 1 0 0 0 0 33 39 1 0 0 0 0 34 40 1 0 0 0 0 36 41 1 0 0 0 0 37 42 1 0 0 0 0 37 43 2 0 0 0 0 39 44 1 0 0 0 0 39 45 1 0 0 0 0 40 46 1 0 0 0 0 40 47 1 0 0 0 0 41 48 1 0 0 0 0 41 49 1 0 0 0 0 42 50 1 0 0 0 0 42 51 1 0 0 0 0 43 52 1 0 0 0 0 44 53 1 0 0 0 0 45 54 1 0 0 0 0 46 55 1 0 0 0 0 47 56 1 0 0 0 0 51 57 1 0 0 0 0 51 58 1 0 0 0 0 53 59 1 0 0 0 0 53 60 2 0 0 0 0 55 61 1 0 0 0 0 55 62 2 0 0 0 0 57 63 1 0 0 0 0 58 64 1 0 0 0 0 59 65 1 0 0 0 0 59 66 1 0 0 0 0 60 67 1 0 0 0 0 61 68 1 0 0 0 0 61 69 1 0 0 0 0 62 70 1 0 0 0 0 63 71 1 0 0 0 0 63 72 1 0 0 0 0 66 73 1 0 0 0 0 66 74 1 0 0 0 0 69 75 1 0 0 0 0 69 76 1 0 0 0 0 71 77 1 0 0 0 0 71 78 1 0 0 0 0 72 79 1 0 0 0 0 73 80 1 0 0 0 0 74 81 1 0 0 0 0 75 82 1 0 0 0 0 76 83 1 0 0 0 0 78 84 1 0 0 0 0 80 85 1 0 0 0 0 80 86 1 0 0 0 0 82 87 1 0 0 0 0 82 88 1 0 0 0 0 84 89 1 0 0 0 0 84 90 1 0 0 0 0 85 91 1 0 0 0 0 85 92 1 0 0 0 0 86 93 1 0 0 0 0 87 94 1 0 0 0 0 87 95 1 0 0 0 0 88 96 1 0 0 0 0 89 97 1 0 0 0 0 92 98 1 0 0 0 0 95 99 1 0 0 0 0 97100 1 0 0 0 0 98101 1 0 0 0 0 98102 1 0 0 0 0 99103 1 0 0 0 0 99104 1 0 0 0 0 100105 1 0 0 0 0 101106 1 0 0 0 0 103107 1 0 0 0 0 105108 1 0 0 0 0 105109 1 0 0 0 0 106110 1 0 0 0 0 107111 1 0 0 0 0 110112 1 0 0 0 0 111113 1 0 0 0 0 112114 1 0 0 0 0 112115 1 0 0 0 0 113116 1 0 0 0 0 113117 1 0 0 0 0 8 12 1 0 0 0 0 10 14 1 0 0 0 0 13 15 1 0 0 0 0 19 20 1 0 0 0 0 38 42 1 0 0 0 0 52 57 1 0 0 0 0 54 59 1 0 0 0 0 56 61 1 0 0 0 0 64 71 1 0 0 0 0 67 73 1 0 0 0 0 70 75 1 0 0 0 0 78 79 1 0 0 0 0 81 85 1 0 0 0 0 83 87 1 0 0 0 0 92 93 1 0 0 0 0 95 96 1 0 0 0 0 M END