MMs01048745 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.4738 0.2792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1632 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5659 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8813 -0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2972 -0.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 0.4555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1548 1.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7389 2.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6021 1.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1142 1.6356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3932 2.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1719 4.2330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1064 2.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 -0.0396 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3450 1.3763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3548 -1.4556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2659 -0.5347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5450 -2.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4026 0.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8185 -0.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0977 -1.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9553 0.9275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3712 0.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5080 1.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9679 1.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7466 2.3487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7679 3.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3844 2.9060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2233 1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -0.2233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2233 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6565 -1.5320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2495 -1.7353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5206 -1.7022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0642 2.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5155 3.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0797 4.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3061 3.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 -2.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7684 -3.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7241 -1.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4736 1.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9894 1.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7319 2.1065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7844 -0.6144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3002 -0.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4315 -0.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9425 2.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0434 4.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 M END