MMs02098874 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 0.7563 1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0126 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4874 2.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2437 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7436 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6312 0.1080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0555 0.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0482 2.0784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6194 2.5350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2733 -0.2973 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2341 -0.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2806 -1.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7094 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5852 -1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6976 0.1731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1542 1.6020 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.5830 1.1454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7254 2.0585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6108 3.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6017 4.1406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0583 5.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5240 5.8884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5331 4.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0765 3.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9806 7.3172 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 3.9080 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9563 1.2896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6177 3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -1.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0866 -1.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0368 -2.9723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2267 -3.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7516 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4809 -1.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4731 -0.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4292 3.8854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2510 6.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7056 5.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8838 2.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END