NCI:202172 BBtclserve11129918172D 0 0.00000 0.00000136353 999-99-9 42 43 0 0 0 0 0 0 0 0 2 V2000 5.4543 2.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 3.3197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5883 3.3197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 1.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 4.3197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 1.2319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 1.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2143 1.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9543 0.2809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 1.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9543 0.2809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 0.8718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.8718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 2.5191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9086 1.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7496 -0.1064 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 1.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6517 0.5117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4927 -0.7755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 -0.4154 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.4438 -0.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6027 0.8207 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.0608 -1.2534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3459 0.1516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8107 1.7988 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.0508 -1.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6878 -2.1812 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6679 -1.8994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3049 -2.9682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6978 -2.3221 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.6672 -1.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3939 -2.8612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2249 -1.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0109 -2.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2239 -3.4189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2226 -1.1008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7850 -0.1348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9726 -3.0759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7804 -0.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2162 -4.0457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6907 -2.3800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1779 -4.3197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 23 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 2 0 0 0 0 32 35 2 0 0 0 0 33 36 1 0 0 0 0 33 37 2 0 0 0 0 34 38 1 0 0 0 0 36 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 2 0 0 0 0 40 42 1 0 0 0 0 9 11 2 0 0 0 0 34 35 1 0 0 0 0 M CHG 6 16 1 20 -1 22 1 25 -1 27 1 30 -1 M END