MMs02941825 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 0.7587 1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0175 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4825 2.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2412 1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2237 3.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4649 5.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7237 3.9223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4824 2.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9824 2.6385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9648 5.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4649 5.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2235 3.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9823 2.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4823 2.6688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2235 3.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4647 5.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9648 5.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 6.5506 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -12.7234 3.9830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4822 2.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7410 1.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.9822 2.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7409 1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2409 1.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9821 2.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2233 4.0133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.7234 4.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9996 0.1213 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9587 1.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6245 3.6332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4412 1.3223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -1.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3575 2.2103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6987 1.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7819 1.4553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1127 2.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7485 6.4168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0897 5.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3345 5.6292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6653 6.4095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3893 1.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0892 1.6336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0577 6.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3164 5.0262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1479 0.3619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1821 2.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1164 5.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7236 3.9425 0.0000 N 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 51 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 M END