MMs01797614 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 56 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 -0.0082 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 -2.2571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2867 -1.0571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 -1.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2785 -3.7570 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2393 -3.1570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0246 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0328 -5.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3195 -3.7428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6226 -4.4857 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6226 -3.2857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6308 -5.9857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9339 -6.7286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2289 -5.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9421 -8.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9175 -3.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2207 -4.4715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5734 -4.5141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8766 -3.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -2.2713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1715 -4.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4746 -3.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7695 -4.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7613 -6.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4582 -6.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1633 -6.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8602 -6.7712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8536 -7.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5653 -6.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2621 -6.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1888 -1.2851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4248 -2.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1842 -2.5567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6323 -0.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9955 -0.4717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -2.5429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4479 -5.7838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2266 -7.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9732 -7.3286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6232 -4.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2648 -5.3658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8345 -7.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1421 -8.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9487 -9.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7422 -8.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4812 -2.5855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8120 -3.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7973 -6.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4517 -7.9854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9094 -2.2287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9453 -1.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 54 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 54 55 1 0 0 0 0 M END