MMs02221162 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 -1.3045 -0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 1.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2825 2.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3155 2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3265 3.7404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 1.4809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9135 2.2214 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9135 1.0214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9245 3.7213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 4.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 5.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5445 6.7022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 1.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9025 -0.7214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5005 -0.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5115 -2.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8160 -2.9428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1095 -2.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0985 -0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 0.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3810 1.5761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6965 -0.6643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7075 -2.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4140 -2.9238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0120 -2.9048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9900 0.0952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0348 -0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3133 -1.9404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6218 2.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2737 3.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6002 0.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7412 3.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5223 4.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6311 3.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4122 4.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9113 -1.9214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.9516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9606 0.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4767 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0468 -2.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0208 -4.1047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9812 1.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0336 -0.4972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9465 6.7213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5115 2.2024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5463 1.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9553 7.9212 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 18 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 9 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 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 50 1 0 0 0 0 16 17 2 0 0 0 0 16 51 1 0 0 0 0 18 19 1 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 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 50 53 1 0 0 0 0 51 52 1 0 0 0 0 M END