MMs00912749 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.6434 -1.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1386 -1.4752 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8280 -0.3161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9202 -2.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3438 -4.1404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3793 -2.4079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 -3.2596 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5748 -3.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 -2.6162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0893 -1.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8546 -0.2693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4996 -0.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1147 -0.3363 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4443 -0.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2038 -3.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0835 -4.9631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5587 -2.8245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7935 -3.6762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1485 -3.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2687 -1.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6237 -0.8941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8584 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7382 -3.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3832 -3.8845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4938 -4.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7285 -5.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -7.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2533 -7.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0185 -6.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1388 -5.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -9.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 0.5148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5148 1.0840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -0.5148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 -1.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7564 -2.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9590 -1.5616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5283 0.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9295 0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9509 -4.5307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4886 -4.6543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2809 -0.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7199 0.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9424 -1.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7260 -3.9224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2870 -5.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2705 -5.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 -7.7831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9346 -7.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -4.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9369 -9.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0368 -10.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3292 -9.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 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 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END