MMs00204592 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 1.1665 0.9430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 2.4247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4028 3.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1668 4.5882 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3149 4.8216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9947 3.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4761 3.2485 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 4.4134 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0210 5.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8847 5.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9024 4.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8473 5.3424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4387 2.7767 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 2.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4564 1.1399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9377 0.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8827 2.0689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3464 3.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8650 3.7057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3640 1.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9004 0.4322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3090 2.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7399 2.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9972 3.2450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3343 2.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4141 1.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7512 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0085 1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9287 2.7034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5916 3.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5118 4.8811 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7544 0.9332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9332 -0.7544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7544 -0.9332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7474 -0.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3015 1.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0054 6.2434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4556 6.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 5.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6827 1.8448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7004 0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3668 -0.2167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1023 4.4017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4359 4.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2409 2.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0650 3.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3771 3.7539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0185 1.4680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 1.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9333 4.4433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4082 0.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -0.8108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0781 0.6617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9345 3.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 M END