MMs01388724 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 -0.7556 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2555 1.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2444 -1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7444 -1.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2444 -1.3215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7444 -1.3279 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1444 -2.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6208 -2.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1512 -3.9698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0494 -2.0878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0558 -0.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2731 0.2886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6312 -0.1182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2591 -2.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6321 -2.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7952 -0.8794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8418 -3.2573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2147 -2.6531 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.2147 -3.8531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5329 -1.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0253 -1.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6295 -2.4097 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -17.6856 -3.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.0659 -1.9773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5105 -3.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 2.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 2.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.3505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -2.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2966 1.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6293 0.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -1.7271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4477 -2.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2653 1.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3924 -3.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9259 -3.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7113 -4.4502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3400 -1.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5380 0.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7808 0.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1682 -0.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8010 -4.3764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3989 -4.2154 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END