MMs00857384 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2449 1.3078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4899 2.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7449 1.3136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -1.2844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8863 -1.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3111 -0.7177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6131 -1.4626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9092 -0.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9033 0.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6014 1.5374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3053 0.7823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8769 1.2403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5956 3.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5897 4.5374 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -11.0955 3.0432 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.0956 3.0315 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -12.2111 -1.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3737 -2.9437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8421 -3.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5871 -1.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5791 -0.8371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4284 -2.6151 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -1.0311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0858 3.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 1.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3409 2.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9402 1.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4851 -3.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3345 -4.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7800 -1.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 25 26 2 0 0 0 0 25 36 1 0 0 0 0 26 27 1 0 0 0 0 26 37 1 0 0 0 0 M END