MMs01722742 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -0.7408 -1.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7225 -3.9023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2225 -3.9129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9633 -5.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2042 -6.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7042 -6.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0366 -5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5366 -5.1855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2957 -6.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5549 -7.7835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7957 -6.4686 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1957 -5.4294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5548 -7.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -9.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5731 -10.3603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0731 -10.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8139 -9.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0548 -7.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5365 -5.1643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0365 -5.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7956 -6.4475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7773 -3.8495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2772 -3.8389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0181 -2.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5087 -2.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8102 -0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3983 -1.1686 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0434 -0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5927 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6655 -0.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6546 -2.0821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8298 -2.8779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1633 -5.2256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7969 -7.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0969 -7.5353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -4.1420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -9.0751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9804 -11.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -11.3848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0139 -9.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3511 -7.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 -2.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8846 -4.8739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3179 -3.2534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9030 -0.4021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3721 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 M END