NCI:132251 BBtclserve11129917402D 0 0.00000 0.00000100322 25698-61-7 36 41 0 0 0 0 0 0 0 0 2 V2000 5.5668 0.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0007 -0.3979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0007 -0.3979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3772 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6242 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4346 0.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5998 -2.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4217 -0.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5992 -0.9572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4017 -2.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8713 1.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4318 0.5779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5007 -2.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 -2.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6886 -1.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2279 -2.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3052 2.2303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8657 1.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -3.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9111 -2.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -1.2704 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1532 -3.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3024 2.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9259 3.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2523 -4.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5105 -0.2954 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9795 -4.2785 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5395 3.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6888 3.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9047 -5.2757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8804 -3.8446 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.4200 3.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7187 4.8018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5993 5.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 2 0 0 0 0 10 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 13 19 2 0 0 0 0 14 20 2 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 17 23 2 0 0 0 0 17 24 1 0 0 0 0 19 25 1 0 0 0 0 21 26 2 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 24 30 1 0 0 0 0 28 31 2 0 0 0 0 28 32 1 0 0 0 0 29 33 2 0 0 0 0 30 34 2 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 10 13 1 0 0 0 0 15 20 1 0 0 0 0 18 23 1 0 0 0 0 22 25 2 0 0 0 0 29 30 1 0 0 0 0 35 36 2 0 0 0 0 M CHG 4 21 1 27 -1 28 1 32 -1 M END