MMs01000533 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -0.7462 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2462 -1.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7538 1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2538 1.2838 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.7538 1.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5075 2.5762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0075 2.5719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7613 3.8687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7537 1.2707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0262 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.2000 -0.0262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0218 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7462 -1.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9924 -2.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7386 -3.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2386 -3.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9924 -2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2462 -1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4924 -2.6374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9848 -5.2311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7613 3.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0151 5.1787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1432 -2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8432 -2.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8568 2.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1568 2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2882 -1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6264 -0.4268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9537 1.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7924 -2.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1356 -4.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8492 -0.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0954 -1.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3818 -6.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 25 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 3 0 0 0 0 M END