MMs00531622 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.7553 -1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0106 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4894 -2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 -1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7106 -1.6260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6057 -0.8267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8614 -3.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4886 -3.7229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1573 -3.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4594 -3.1290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7554 -3.8843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0575 -3.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0636 -1.6396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3534 -3.8948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6555 -3.1501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9515 -3.9054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9454 -5.4054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2536 -3.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2597 -1.6607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5618 -0.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8577 -1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8516 -3.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5496 -3.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1476 -3.9266 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5958 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9553 -1.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6148 -3.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1042 1.0307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3823 -4.7898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9249 -4.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6918 -2.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2345 -2.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7505 -5.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5784 -4.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1210 -4.8172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6604 -1.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2229 -1.0565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5666 0.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8994 -1.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5447 -5.1160 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 M END