MMs02126244 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 37 0 0 1 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 0.7494 1.2994 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3494 0.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0013 2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6013 3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0019 3.7133 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8504 4.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3725 3.1039 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2210 2.2553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2164 1.6120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6711 3.8545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0418 3.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0449 4.3603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5123 4.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5154 5.1644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9765 2.6228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1504 2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9734 1.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 1.8187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4376 0.0812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2943 5.6590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8272 5.3464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 6.3495 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6893 5.1804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4522 5.5506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5013 2.5973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2506 1.2979 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 2.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1278 -0.4099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2078 -1.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6351 -0.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6115 -0.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5808 0.6046 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 24 25 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 27 34 1 0 0 0 0 M CHG 1 34 -1 M END