NCI:617999 BBtclserve11129919372D 0 0.00000 0.00000209981 999-99-9 40 42 0 0 0 0 0 0 0 0 2 V2000 12.4261 2.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7807 1.8588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1194 0.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1036 0.7409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7491 1.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4103 2.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2755 -0.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1415 -0.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1415 -1.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2755 -2.2442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4095 -1.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4095 -0.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4704 -0.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2985 0.5845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7332 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0076 -0.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0076 0.7557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8736 -0.7443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7396 -0.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6056 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0076 -2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5435 -2.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7032 -1.0419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7641 -0.6984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9969 -1.3397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0579 -0.9961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2907 -1.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4626 -2.6226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3516 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5844 -1.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6454 -1.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4734 -0.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2406 0.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1797 -0.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5343 -0.2629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9103 2.3118 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.5562 0.3434 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.7174 1.1505 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7672 -0.9044 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5458 0.0000 N 0 5 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 5 15 1 0 0 0 0 8 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 9 21 1 0 0 0 0 11 22 1 0 0 0 0 13 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 29 34 2 0 0 0 0 32 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 35 39 2 0 0 0 0 39 40 2 0 0 0 0 5 6 1 0 0 0 0 11 12 2 0 0 0 0 33 34 1 0 0 0 0 M CHG 2 39 1 40 -1 M END