MMs00041244 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 0.7421 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0157 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6157 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5157 -2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2735 -3.8834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5314 -5.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0314 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7264 -3.9016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3264 -2.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2264 -3.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9685 -5.2142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2107 -6.5087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 -5.2233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2106 -6.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7106 -6.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4527 -7.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7735 -3.8744 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7644 -2.3744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7826 -5.3743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2735 -3.8653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0313 -5.1598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5313 -5.1507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2734 -3.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5156 -2.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0156 -2.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7734 -3.8381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5312 -5.1325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5937 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6567 -2.0804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3002 -1.4085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6408 -2.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6615 -5.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3302 -6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0937 -5.6133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0252 -2.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3565 -3.5071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0748 -4.1877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0805 -6.9304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4118 -7.7098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5094 -5.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8407 -6.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6527 -7.8467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4376 -6.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1376 -6.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1093 -1.5098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4093 -1.5261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5668 -4.5263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1375 -6.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4957 -5.7388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END