MMs01308789 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 69 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 1.4668 0.3138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -0.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0104 -2.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0156 -3.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4824 -3.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -1.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9388 -0.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4876 -4.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9792 -3.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5911 -5.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4777 -6.3555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1777 -5.6073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6365 -7.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4242 -8.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 -10.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9541 -10.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1665 -9.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0077 -8.4553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7274 -2.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2274 -2.6787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9792 -3.9768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4791 -3.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2309 -5.2728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2274 -2.6747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4757 -1.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2239 -0.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7239 -0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4756 -1.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7274 -2.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9756 -1.3706 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.9777 -2.8706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9736 0.1294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4756 -1.3686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2239 -0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4721 1.2295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2204 2.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7204 2.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4721 1.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7239 -0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4756 -1.3646 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2511 1.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1734 -0.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2511 -1.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -2.4778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6463 -4.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1174 -1.3480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3081 0.6561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7652 -5.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3273 -8.2438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6131 -10.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0812 -12.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2634 -10.4335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9775 -7.7487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1260 -1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3806 -5.0168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2757 -1.3783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6225 0.9618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3225 0.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3288 -3.7111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0770 -2.4070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2721 1.2279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6190 3.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3190 3.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6721 1.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 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 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 38 39 2 0 0 0 0 38 64 1 0 0 0 0 39 40 1 0 0 0 0 39 65 1 0 0 0 0 40 41 1 0 0 0 0 M END