NCI:667440 BBtclserve11129920112D 0 0.00000 0.00000234106 999-99-9 120125 0 0 0 0 0 0 0 0 1 V2000 11.2715 -4.9409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4662 -2.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4673 -2.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9267 -3.7283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1709 -4.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2613 -4.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5179 3.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5078 3.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8794 2.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2613 1.9435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2714 2.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8998 3.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6185 0.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1592 1.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 1.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6163 0.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0756 0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0767 0.0795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 0.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3837 1.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3849 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9267 0.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4673 0.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4662 0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 -4.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6163 -3.7283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6713 -4.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 -5.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2378 -5.6921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1828 -5.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0068 -2.0933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3869 -1.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7827 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3791 -0.9219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9990 -1.9685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -0.8093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9955 -1.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4537 -2.4918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.5554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5361 -0.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2816 2.2281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9201 3.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 2.5127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5485 4.2272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9100 3.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0079 -0.8093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4832 -2.3657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4590 -2.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1846 -3.3201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0068 -0.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7009 2.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2427 3.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5898 3.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8121 2.2402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1259 4.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7441 5.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9120 3.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3399 5.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8420 2.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3002 3.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9531 3.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7308 2.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7116 -5.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 -6.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5528 -4.6837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8703 -5.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0485 -6.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8593 -7.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0305 -6.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 -6.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8618 -4.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5632 -5.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2405 -5.7460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9419 -6.7004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2089 -3.5387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0788 -4.5302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8724 -5.1386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7425 -6.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1666 5.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 5.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4131 6.7276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0415 7.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5587 4.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 5.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1972 5.4402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8255 6.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5384 -0.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5395 -0.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0813 0.2698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0824 0.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -2.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4571 -2.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9989 -1.4602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7671 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7592 0.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1472 1.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1394 1.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9833 -1.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9755 -1.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5797 -2.3907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5719 -2.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6834 -3.3681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9721 -3.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8176 -2.6479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1938 -4.2637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9050 -3.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3483 -5.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5699 -5.8794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7245 -6.8674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9462 -7.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2609 -3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 -4.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6371 -5.5193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8587 -6.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2817 -4.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 -1.9275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 1.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1709 1.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7490 -1.9275 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 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 7 12 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 13 18 1 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 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 25 30 2 0 0 0 0 2 31 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 31 35 1 0 0 0 0 17 36 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 36 40 1 0 0 0 0 11 41 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 41 45 1 0 0 0 0 23 46 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 46 50 1 0 0 0 0 14 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 8 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 20 59 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 62 1 0 0 0 0 5 63 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63 66 1 0 0 0 0 29 67 1 0 0 0 0 67 68 1 0 0 0 0 67 69 1 0 0 0 0 67 70 1 0 0 0 0 49 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 49 75 1 0 0 0 0 75 76 1 0 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 44 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 82 1 0 0 0 0 44 83 1 0 0 0 0 83 84 1 0 0 0 0 84 85 1 0 0 0 0 85 86 1 0 0 0 0 39 87 1 0 0 0 0 87 88 1 0 0 0 0 88 89 1 0 0 0 0 89 90 1 0 0 0 0 39 91 1 0 0 0 0 91 92 1 0 0 0 0 92 93 1 0 0 0 0 93 94 1 0 0 0 0 34 95 1 0 0 0 0 95 96 1 0 0 0 0 96 97 1 0 0 0 0 97 98 1 0 0 0 0 34 99 1 0 0 0 0 99100 1 0 0 0 0 100101 1 0 0 0 0 101102 1 0 0 0 0 26103 1 0 0 0 0 104105 2 0 0 0 0 104106 1 0 0 0 0 103107 1 0 0 0 0 106108 1 0 0 0 0 108109 1 0 0 0 0 109110 1 0 0 0 0 110111 1 0 0 0 0 106112 1 0 0 0 0 112113 1 0 0 0 0 113114 1 0 0 0 0 114115 1 0 0 0 0 1116 1 0 0 0 0 18117 1 0 0 0 0 12118 1 0 0 0 0 10119 1 0 0 0 0 3120 1 0 0 0 0 5 6 1 0 0 0 0 11 12 2 0 0 0 0 17 18 2 0 0 0 0 23 24 2 0 0 0 0 29 30 1 0 0 0 0 32 35 1 0 0 0 0 37 40 1 0 0 0 0 42 45 1 0 0 0 0 47 50 1 0 0 0 0 104107 1 0 0 0 0 25116 1 0 0 0 0 27117 1 0 0 0 0 16118 1 0 0 0 0 22119 1 0 0 0 0 24120 1 0 0 0 0 M END