MMs03572396 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 0.1658 -1.4908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4694 -2.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1664 -3.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3244 -3.8678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9428 -2.5012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4119 -2.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5205 -3.2087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8241 -2.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5211 -0.9975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3294 -0.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0303 -0.8317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1907 -3.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3384 -4.5777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4095 -2.2106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7761 -2.8290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9949 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8472 -0.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3615 -2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5093 -4.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8759 -4.6842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0947 -3.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9470 -2.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5804 -1.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1658 -1.4429 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -16.5324 -2.0613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0181 0.0498 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1926 0.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1327 1.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1926 -0.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5627 -1.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9747 -4.5889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 -4.9107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3878 -4.4013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2913 -1.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8943 -4.0232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7539 0.0327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8223 0.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5342 -4.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9941 -5.8784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1880 -4.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4622 -0.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 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 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END