MMs01431615 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 47 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 1.5000 0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2441 1.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2558 -1.2889 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8558 -2.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7558 -1.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5117 -2.5777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 1.3295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7558 -1.2685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5117 -2.5913 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8754 -1.3885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2999 -1.8585 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2931 -3.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8644 -3.8155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3945 -5.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0741 -5.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5441 -6.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5026 -4.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8757 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0852 -4.5289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9217 -6.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5486 -6.6238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3391 -5.7367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1312 -6.9071 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0054 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0054 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 0.7139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8394 2.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2022 1.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 1.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1605 -2.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9558 -1.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -5.4124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4309 -6.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8731 -4.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 -7.8651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -7.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0065 -2.4489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1837 -4.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4178 -7.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2407 -6.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 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 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 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 45 1 0 0 0 0 26 46 1 0 0 0 0 M END