MMs03838161 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 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 1.3381 -0.6779 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5762 -2.1589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0583 -2.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7361 -1.0520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9209 -0.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9042 1.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7363 2.4296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3033 2.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4712 1.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8704 1.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1016 3.1107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9336 4.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5345 3.5112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3666 4.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5978 5.9345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9969 6.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 5.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0383 0.6874 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4374 1.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6053 0.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3741 -1.1951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0044 0.8278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1723 -0.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5714 0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7394 -0.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1385 0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3697 1.5090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2018 2.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8026 1.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5423 1.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 0.5423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5423 -1.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7296 -3.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6056 -3.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2863 -0.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2473 4.0198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6635 6.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1819 7.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2841 5.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8169 2.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3412 2.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1894 2.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2685 -0.9029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7928 -1.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5544 -1.6996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0728 -0.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4890 1.9416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3867 3.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8683 2.6624 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 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 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 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 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 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 M CHG 1 2 1 M END