MMs01413383 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 0.7422 -1.3035 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3422 -2.3427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 -1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9844 -2.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2578 1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 1.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7577 1.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7421 -1.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2421 -1.3305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 -2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 -1.2855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2733 -3.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5311 -5.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2889 -6.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7889 -6.4726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5311 -5.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7733 -3.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0311 -5.1601 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0221 -3.6601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0401 -6.6600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 -5.1511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -6.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8438 -5.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8348 -4.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4054 -3.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5214 0.2969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3006 1.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 2.3283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7363 0.9886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6639 2.3103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3639 2.2941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6998 -0.0522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3358 -2.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6359 -2.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3312 -5.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6952 -7.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3951 -7.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3671 -2.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3844 -6.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9146 -7.4526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1003 -7.0595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0364 -5.7546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0289 -4.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0772 -3.2120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3626 -3.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8869 -2.8331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END