MMs03268063 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7395 -1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2394 -1.3172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0243 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5999 -1.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2393 -1.3415 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 -1.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2392 -1.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9787 -2.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4786 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2391 -1.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7271 -2.8536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0201 -3.6141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0079 -5.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7029 -5.8535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4099 -5.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4221 -3.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7514 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0565 0.8858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0686 2.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7757 3.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4706 2.4068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4585 0.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2604 1.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0209 2.5737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0441 0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5916 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -2.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 1.1470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6308 0.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6745 -3.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0702 -3.7270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4391 -1.3997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1080 0.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7039 0.4492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5421 -3.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0423 -5.7224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6931 -7.0534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3659 -5.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3877 -2.9846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5736 0.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1127 2.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7854 4.3462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4363 3.0152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9365 0.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7605 1.2929 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 51 -1 M END