D0MM4X 09211001072D 1 1.00000 0.00000 0 44 48 0 1 0 999 V2000 7.4083 1.7417 0.0000 O 0 0 0 0 0 0 0 0 0 7.4125 1.0333 0.0000 S 0 0 3 0 0 0 0 0 0 8.0239 1.3911 0.0000 O 0 0 0 0 0 0 0 0 0 5.6360 0.4312 0.0000 C 0 0 0 0 0 0 0 0 0 6.3445 0.4315 0.0000 C 0 0 2 0 0 0 0 0 0 5.4168 -0.2404 0.0000 N 0 0 3 0 0 0 0 0 0 1.1277 -0.6083 0.0000 C 0 0 0 0 0 0 0 0 0 1.1266 -1.3190 0.0000 C 0 0 0 0 0 0 0 0 0 1.7414 -1.6735 0.0000 C 0 0 0 0 0 0 0 0 0 2.3537 -1.3185 0.0000 C 0 0 0 0 0 0 0 0 0 2.3508 -0.6047 0.0000 C 0 0 0 0 0 0 0 0 0 1.7396 -0.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0.5129 -1.6728 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4694 -0.6079 0.0000 N 0 0 3 0 0 0 0 0 0 -2.4694 -1.3162 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8574 -1.6704 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2453 -1.3162 0.0000 N 0 0 3 0 0 0 0 0 0 -1.2453 -0.6079 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8574 -0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6317 -1.6701 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0830 -0.2540 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4125 -2.3417 0.0000 S 0 0 0 0 0 0 0 0 0 0.2958 -2.3417 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0584 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 2.9631 -0.2485 0.0000 C 0 0 0 0 0 0 0 0 0 3.5777 -0.6006 0.0000 N 0 0 0 0 0 0 0 0 0 2.9608 0.4598 0.0000 O 0 0 0 0 0 0 0 0 0 4.1899 -0.2445 0.0000 C 0 0 2 0 0 0 0 0 0 4.8045 -0.5966 0.0000 C 0 0 0 0 0 0 0 0 0 4.8069 -1.3049 0.0000 O 0 0 0 0 0 0 0 0 0 4.1876 0.4639 0.0000 C 0 0 0 0 0 0 0 0 0 4.7999 0.8201 0.0000 C 0 0 3 0 0 0 0 0 0 4.7976 1.5284 0.0000 C 0 0 0 0 0 0 0 0 0 6.5661 -0.2420 0.0000 C 0 0 2 0 0 0 0 0 0 5.9902 -0.6605 0.0000 C 0 0 1 0 0 0 0 0 0 6.2102 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 6.9222 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 7.1421 -0.6605 0.0000 O 0 0 0 0 0 0 0 0 0 5.7938 -1.9107 0.0000 O 0 0 0 0 0 0 0 0 0 7.1750 0.1167 0.0000 H 0 0 0 0 0 0 0 0 0 5.3708 -1.0083 0.0000 H 0 0 0 0 0 0 0 0 0 6.7055 1.0409 0.0000 O 0 0 0 0 0 0 0 0 0 7.7611 0.4157 0.0000 C 0 0 0 0 0 0 0 0 0 5.5042 0.8208 0.0000 C 0 0 0 0 0 0 0 0 0 10 11 1 0 0 0 35 6 1 0 0 0 11 12 2 0 0 0 23 13 2 0 0 0 13 24 1 0 0 0 24 20 2 0 0 0 20 22 1 0 0 0 12 7 1 0 0 0 11 25 1 0 0 0 6 4 1 0 0 0 25 26 1 0 0 0 8 13 1 0 0 0 25 27 2 0 0 0 14 15 1 0 0 0 26 28 1 0 0 0 4 5 1 0 0 0 28 29 1 0 0 0 29 6 1 0 0 0 29 30 2 0 0 0 7 8 2 0 0 0 28 31 1 1 0 0 2 1 2 0 0 0 31 32 1 0 0 0 8 9 1 0 0 0 32 33 1 0 0 0 34 35 1 0 0 0 3 2 2 0 0 0 14 19 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 34 1 0 0 0 18 19 1 0 0 0 36 39 2 0 0 0 9 10 2 0 0 0 34 40 1 6 0 0 17 20 1 0 0 0 35 41 1 6 0 0 5 34 1 0 0 0 5 42 1 1 0 0 42 2 1 0 0 0 14 21 1 0 0 0 2 43 1 0 0 0 22 23 1 0 0 0 32 44 1 0 0 0 M END $$$$