MMs00483111 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 1.2297 -0.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4594 -1.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0887 0.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3707 -2.0887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1237 -1.9596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7592 -0.6009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9827 -3.1893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3472 -4.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4771 -3.0603 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8771 -4.0995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1126 -1.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -1.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2425 -0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7369 -0.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5959 -1.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9604 -2.6732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 -2.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0903 -1.1854 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.7258 0.1734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9493 -2.4151 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3361 -4.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7006 -5.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3436 0.4919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9838 0.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6872 -0.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7722 -2.7017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4432 -2.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -1.2261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5806 0.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7759 1.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5968 0.7143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4342 -5.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8389 -5.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2602 -4.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9538 -1.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2185 -0.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5553 0.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2453 1.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6476 -3.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2118 -3.3457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8305 -4.1609 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 42 -1 M END