MMs01671768 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 0.7456 -1.3016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2456 -1.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9912 -2.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2368 -3.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9824 -5.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4824 -5.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2368 -3.9149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4912 -2.6133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2279 -6.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7279 -6.5180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4823 -5.2216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9823 -5.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7367 -3.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9911 -2.6286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2367 -3.9352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9911 -2.6387 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5911 -3.6780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2455 -1.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 -0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 -0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2455 -1.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4911 -2.6438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2367 -3.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7367 -3.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4911 -2.6540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7455 -1.3524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0368 -3.9007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3788 -6.2435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4367 -3.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0947 -1.5761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6244 -7.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7699 -6.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1086 -5.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8332 -4.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3237 -2.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3289 -0.5627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8737 0.3736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2123 1.1404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2956 1.1367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6289 0.3608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6332 -4.9826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3332 -4.9918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6911 -2.6581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3490 -0.3152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END