MMs01617808 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.7464 -1.3011 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3464 -0.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2464 -1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9927 -2.6065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2463 -1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7463 -1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7536 1.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2536 1.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5072 2.5771 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7609 3.8782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0072 2.5729 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0073 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5073 -2.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2536 -1.2927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2609 -3.8908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7609 -3.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5145 -5.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7681 -6.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0145 -5.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8996 -6.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3249 -5.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3207 -4.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8928 -3.9634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0409 0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4029 1.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6434 -2.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3434 -2.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 -0.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6565 2.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1344 -4.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4726 -5.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5492 -2.7054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8874 -3.4730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5319 -7.5327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2976 -6.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2895 -3.7148 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 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 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 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END