MMs01186315 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.3679 -0.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -2.1078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4004 -3.1072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0908 -2.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9772 -4.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3724 -5.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1188 -5.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0052 -4.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4975 -4.3288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8151 -2.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1878 -2.2580 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1878 -3.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3503 -0.7669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3979 -3.1444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7705 -2.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 -1.0484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9806 -3.4260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8181 -4.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0282 -5.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4008 -5.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5634 -3.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3533 -2.8212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5159 -1.3300 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2587 -6.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -8.1101 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4923 1.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0944 0.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4923 -1.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6628 0.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5647 -0.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5746 -1.8465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1701 -4.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 -6.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5433 -0.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4804 0.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1574 -0.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2678 -4.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7199 -5.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8981 -6.9964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3689 -5.9078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6615 -3.2237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7499 -6.5749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 43 2 0 0 0 0 M CHG 1 26 -1 M END