MMs03079899 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -1.0819 1.0390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4282 2.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 3.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0738 4.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4122 4.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 3.3690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0578 2.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3224 0.7079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6725 0.0542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6725 1.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9371 -1.4223 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2477 -2.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4231 -1.6269 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6231 -1.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0768 -0.2769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3874 0.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9949 0.7621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5533 -0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5207 -1.1586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9972 -0.8940 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.7326 0.5825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4737 -0.6294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4411 -1.7757 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.2947 -2.7431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5874 -0.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9984 -1.3174 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.4893 -2.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -2.9493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -3.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8981 -2.5042 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3323 5.9428 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 3.9828 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1637 -1.1888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1397 1.1142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5909 0.5907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9326 5.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2161 3.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2618 -2.3705 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.4085 -2.9221 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.5075 0.0936 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.4094 -1.8264 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 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 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 29 30 1 0 0 0 0 33 37 1 0 0 0 0 33 38 1 0 0 0 0 M CHG 1 31 -1 M CHG 1 39 -1 M CHG 1 40 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END