MMs01722588 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 0.7477 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7431 -3.8984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 -3.9011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9954 -2.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2477 -1.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9908 -5.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4823 -5.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7915 -6.8287 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4912 -7.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3782 -6.5707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3317 -9.0679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4879 -4.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9546 -4.5624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4156 -5.9898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9603 -3.4495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4270 -3.7640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4326 -2.6510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9716 -1.2236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8993 -2.9655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9050 -1.8526 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2155 -3.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4440 -0.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4496 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9163 0.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3773 -1.0541 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.2258 -0.2056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3716 -2.1671 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.5307 -2.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8326 -3.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8440 -1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0403 0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5982 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 -0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2046 -2.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1412 -4.9366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1954 -2.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8495 -0.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2346 -9.5540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3013 -9.7749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4714 -3.6103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9395 -3.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9755 -4.8758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4435 -4.4017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2681 -4.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3834 -0.9867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7069 0.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4331 1.3255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9011 1.7996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9603 1.5725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1049 0.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6907 -3.9633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2014 -4.7364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9745 -3.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5924 -2.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0173 -1.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0955 -0.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END