MMs01862274 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 65 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 1.4730 0.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 -0.8510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9278 -0.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9095 -1.7020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3825 -1.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8739 -0.0016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3643 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0238 -4.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3079 -4.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2786 -6.2888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9652 -7.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9358 -8.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6224 -9.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3383 -8.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3676 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 -6.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7103 -4.7383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 -3.8073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8588 -2.4253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6341 -1.1412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1338 -1.1705 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1045 -2.6702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1631 0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6335 -1.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4087 0.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9085 0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6329 -1.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8577 -2.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3580 -2.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1326 -1.2878 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.9029 -4.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3384 -5.5832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4332 -6.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2910 -8.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7264 -7.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7557 -6.0745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2265 1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1784 -0.2265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2265 -1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0453 1.4043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5029 0.8990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4249 -1.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8825 -1.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5001 0.5533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9577 0.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5165 -2.8358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9631 -9.1331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5989 -10.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -9.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3403 -6.3423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0545 -0.0905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8292 1.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5287 1.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4373 -3.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7378 -3.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9355 -3.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0942 -4.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2334 -6.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 -9.1436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6832 -8.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 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 1 0 0 0 0 5 47 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 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 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 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 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 34 2 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 2 0 0 0 0 35 60 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 M END