MMs03822728 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 48 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 1.3235 0.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 1.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9201 0.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2436 1.3244 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3951 2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4505 2.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9274 3.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6333 1.7489 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5927 0.6686 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7442 -0.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 -0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.8531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4639 -1.1338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1698 -2.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6467 -2.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8535 -0.7093 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7020 -1.5578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5045 -0.0534 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3530 0.7951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 1.3879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1298 2.4683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1770 -0.0034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4501 -0.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3997 -2.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7736 -0.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1227 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1633 0.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4574 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9805 1.3949 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0185 0.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 2.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4489 2.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2512 2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3653 4.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5952 4.2256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0394 3.5234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0577 -2.9082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5020 -3.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7319 -3.3919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8460 -2.2353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2174 1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3326 -1.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3518 0.1683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9821 2.7365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 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 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 M END