MMs01394578 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 -1.5000 0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2464 1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4928 2.6022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0072 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7536 1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2536 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2464 -1.3136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7464 1.3095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7422 2.8095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7505 -0.1905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2464 1.3136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9928 2.6148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4927 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2464 1.3220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7463 1.3261 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7422 2.8261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7505 -0.1738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2463 1.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4999 0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2463 1.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4927 2.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9927 2.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2391 3.9367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.7391 3.9409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4927 2.6440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7463 1.3428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1029 -1.0334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0899 3.6431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6101 3.6356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8565 2.3303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3971 -1.0459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 3.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1978 3.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2811 3.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6192 3.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6287 -0.3864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2949 -1.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8735 -0.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2116 -1.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4028 -1.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1028 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3898 3.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5274 5.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8656 4.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4098 3.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4141 1.8752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2536 1.2844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4536 1.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 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 9 10 2 0 0 0 0 9 54 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 54 55 1 0 0 0 0 M END