MMs00925773 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 0.7567 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0134 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 -1.2875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 -1.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2433 1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9866 2.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2299 3.9086 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9348 3.1520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5251 4.6653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4733 5.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2433 1.3260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2566 -1.2720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7566 -1.2643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7565 -1.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0132 -2.5518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5133 -2.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7699 -3.8470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2699 -3.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0132 -2.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2565 -1.2412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5181 0.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -2.3236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7857 0.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3201 2.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9098 1.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 3.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5094 5.8091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8679 6.2399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4371 4.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -2.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8946 1.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5945 1.0885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9186 -3.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0676 -5.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3996 -4.2439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9364 -3.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9285 -1.7603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END