NCI:140494 BBtclserve11129917462D 0 0.00000 0.00000105812 999-99-9 148163 0 0 0 0 0 0 0 0 1 V2000 3.0181 9.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9135 8.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7226 7.5155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6361 7.9222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7406 8.9167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9316 9.5045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 7.6965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2091 9.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4451 7.3344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 9.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8621 10.3016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8566 10.4062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2633 9.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5202 8.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2415 9.2847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3566 11.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8566 12.1382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3566 13.0042 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.8566 13.8703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2226 12.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4906 13.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8377 2.0365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8866 2.3455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8866 3.3455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8377 3.6545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4255 2.8455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0206 1.8455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1546 2.3455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1546 3.3455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0206 3.8455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0206 0.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2886 3.8455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1467 4.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5589 5.4146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1467 6.2236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0978 5.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0978 4.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9068 6.5024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8377 7.1747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8595 7.3826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5505 8.3337 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.5016 8.6427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5995 8.0246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3309 7.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0000 6.3246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6910 5.3736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7129 5.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0438 5.9088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.3528 6.8599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9782 6.5325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6399 8.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4039 4.2146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0656 5.7009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3225 6.3700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4564 5.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6643 4.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6589 4.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9952 4.1487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5429 6.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7339 5.6890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5521 -1.8444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9643 -2.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0132 -2.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0132 -1.3444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9643 -1.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1722 -3.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4291 -4.3007 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4780 -3.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2701 -3.0135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.1233 -3.9406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7349 -4.6608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2042 -0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2042 0.2434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2532 0.5524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6654 -0.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2532 -1.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6654 -0.2566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9441 1.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6133 2.2466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3042 3.1977 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 14.3532 2.8886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2553 3.5067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8203 6.0957 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.2271 7.0092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4136 5.1821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3268 -4.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2223 -5.1576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0313 -5.7454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9449 -5.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0494 -4.3441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2404 -3.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3088 -5.5644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5178 -3.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7539 -5.9264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9630 -3.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1709 -2.9592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1654 -2.8547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5721 -3.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8290 -4.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6654 -1.9887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6654 -1.9887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1071 -9.9693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5194 -10.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5683 -10.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5683 -9.4693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5193 -9.1603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7273 -11.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9841 -12.4256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0331 -12.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8252 -11.1384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6783 -12.0654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2899 -12.7857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7593 -8.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7593 -7.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8082 -7.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2204 -8.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8082 -9.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2204 -8.3815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4992 -6.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1683 -5.8783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8593 -4.9272 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.9082 -5.2362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8103 -4.6182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5864 -13.8703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7774 -13.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8819 -12.2880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7954 -11.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6045 -12.4690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4999 -13.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8638 -13.6892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -10.8867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -12.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7259 -11.0841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7204 -10.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1272 -11.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3840 -12.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1053 -12.1010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2204 -10.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2204 -10.1136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7204 -9.2475 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.8544 -8.7475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5865 -9.7475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1654 -1.1227 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.2993 -0.6227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0314 -1.6226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5503 -3.9762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4886 -13.5568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.9782 0.0000 0.0000 N 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 3 4 1 0 0 0 0 4 5 1 0 0 0 0 1 6 2 0 0 0 0 2 7 2 0 0 0 0 1 8 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 10 14 1 0 0 0 0 13 15 1 0 0 0 0 12 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 22 26 2 0 0 0 0 23 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 24 30 1 0 0 0 0 27 31 1 0 0 0 0 29 32 1 0 0 0 0 25 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 33 37 1 0 0 0 0 36 38 1 0 0 0 0 35 39 1 0 0 0 0 39 40 1 0 0 0 0 15 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 44 49 2 0 0 0 0 45 50 2 0 0 0 0 44 51 1 0 0 0 0 47 52 2 0 0 0 0 48 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 53 57 1 0 0 0 0 56 58 1 0 0 0 0 55 59 1 0 0 0 0 59 60 1 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 64 1 0 0 0 0 61 65 2 0 0 0 0 62 66 1 0 0 0 0 66 67 2 0 0 0 0 67 68 1 0 0 0 0 63 69 1 0 0 0 0 66 70 1 0 0 0 0 68 71 1 0 0 0 0 64 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 72 76 1 0 0 0 0 75 77 1 0 0 0 0 74 78 1 0 0 0 0 78 79 1 0 0 0 0 58 80 1 0 0 0 0 80 81 2 0 0 0 0 80 82 1 0 0 0 0 38 83 1 0 0 0 0 83 84 2 0 0 0 0 83 85 1 0 0 0 0 86 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 86 91 2 0 0 0 0 87 92 2 0 0 0 0 86 93 1 0 0 0 0 89 94 2 0 0 0 0 90 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 95 99 1 0 0 0 0 97100 1 0 0 0 0 100101 1 0 0 0 0 102103 1 0 0 0 0 103104 2 0 0 0 0 104105 1 0 0 0 0 102106 2 0 0 0 0 103107 1 0 0 0 0 107108 2 0 0 0 0 108109 1 0 0 0 0 104110 1 0 0 0 0 107111 1 0 0 0 0 109112 1 0 0 0 0 105113 1 0 0 0 0 113114 1 0 0 0 0 114115 1 0 0 0 0 115116 1 0 0 0 0 113117 1 0 0 0 0 116118 1 0 0 0 0 115119 1 0 0 0 0 119120 1 0 0 0 0 120121 1 0 0 0 0 121122 2 0 0 0 0 121123 1 0 0 0 0 124125 1 0 0 0 0 125126 1 0 0 0 0 126127 1 0 0 0 0 127128 1 0 0 0 0 124129 2 0 0 0 0 125130 2 0 0 0 0 127131 2 0 0 0 0 128132 1 0 0 0 0 132133 1 0 0 0 0 133134 1 0 0 0 0 134135 1 0 0 0 0 132136 1 0 0 0 0 135137 1 0 0 0 0 134138 1 0 0 0 0 138139 1 0 0 0 0 118140 1 0 0 0 0 140141 2 0 0 0 0 140142 1 0 0 0 0 77143 1 0 0 0 0 143144 2 0 0 0 0 143145 1 0 0 0 0 98146 1 0 0 0 0 136147 1 0 0 0 0 5 6 1 0 0 0 0 13 14 1 0 0 0 0 25 26 1 0 0 0 0 29 30 2 0 0 0 0 36 37 1 0 0 0 0 40 41 1 0 0 0 0 48 49 1 0 0 0 0 56 57 1 0 0 0 0 64 65 1 0 0 0 0 68 69 2 0 0 0 0 75 76 1 0 0 0 0 79 80 1 0 0 0 0 60 83 1 0 0 0 0 90 91 1 0 0 0 0 98 99 1 0 0 0 0 105106 1 0 0 0 0 109110 2 0 0 0 0 116117 1 0 0 0 0 128129 1 0 0 0 0 135136 1 0 0 0 0 139140 1 0 0 0 0 101143 1 0 0 0 0 121146 1 0 0 0 0 M END