MMs01372763 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 0.7428 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0145 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5145 2.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2572 1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7572 1.2781 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1572 2.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7427 -1.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4855 -2.6231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5144 2.5730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0144 2.5646 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0227 4.0646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 1.0646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5144 2.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2716 3.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7716 3.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5143 2.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7571 1.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2571 1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 -0.0585 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.5288 5.1376 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2717 3.8845 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9427 1.3099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5797 3.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7971 -0.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4235 0.7411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4149 -0.8015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9202 3.6155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6774 4.8936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7143 2.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6513 0.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2427 -1.3116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6369 -2.3474 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 34 1 0 0 0 0 35 36 1 0 0 0 0 M END