MMs03635174 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.4741 -0.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -1.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4451 -1.9701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4224 -0.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9255 0.5832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4514 0.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8738 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3479 -0.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -1.6046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4777 -1.4129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7551 0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4388 0.7806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2471 2.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4396 3.1782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2479 4.6659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8636 5.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6711 4.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8628 2.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6719 6.7314 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.1107 0.7033 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3446 -0.1496 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1931 -0.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2228 -1.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7002 0.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8220 1.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9341 -0.3605 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2897 0.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5236 -0.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8792 0.0706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0010 1.5657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7671 2.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4115 1.7766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2219 1.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1793 0.2219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2219 -1.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1892 -2.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8426 -3.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7074 1.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0539 1.9928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2971 1.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8415 0.6403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5470 2.7160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2019 5.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5637 4.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9088 2.1182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0268 -1.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1254 -2.8407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4188 -1.7421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8367 -1.5566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4262 -1.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8663 -0.6118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0855 2.0793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8645 3.6147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4244 2.4590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8965 -1.1095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -2.2418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 56 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 21 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 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 56 57 1 0 0 0 0 M END