MMs02792859 MOE2007 2D CORINA 3.40 0006 02.08.2006 74 78 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 1.4969 0.0959 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7095 1.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7899 1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5018 0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0012 -0.0349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5724 -2.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0718 -2.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7837 -1.1372 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3837 -2.1765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9963 0.1395 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3963 1.1787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7082 1.4597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3082 2.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2076 1.5033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 0.2266 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2831 -1.0937 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2831 -2.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3188 -2.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6708 -1.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4707 -0.0425 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9370 0.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3964 1.7015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9439 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4102 -0.5221 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4171 -1.6339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8834 -1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3429 0.1101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8904 -2.4297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3567 -2.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3636 -3.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9042 -4.6533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4378 -4.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4309 -3.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8548 1.4075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8838 1.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 2.7364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0767 1.1975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 -0.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0767 -1.1975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 1.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4669 2.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6159 2.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9289 1.7065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2839 -2.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4572 -2.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -3.6763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8978 -3.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2109 -2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 2.6785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3228 1.9463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3688 -2.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9487 -3.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0746 -2.6591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2538 -1.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4360 -1.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3966 -1.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4013 -2.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8699 -2.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9039 -1.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3725 -1.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0996 -2.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4247 -3.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8906 -6.0807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4220 -5.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3698 -3.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6949 -4.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0038 2.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8505 0.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5948 2.4017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9171 2.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4904 3.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 39 74 1 0 0 0 0 M END