MMs00886195 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 67 0 0 0 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 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2564 -1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5128 -2.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0128 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7436 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4437 -4.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7742 -4.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9834 -4.0149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1264 -4.3801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7816 -6.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0843 -7.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0917 -8.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7964 -9.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5063 -8.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5137 -7.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8038 -10.9025 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8679 -4.4975 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9876 -3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4119 -3.9698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5315 -2.9716 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9558 -3.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2604 -4.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0755 -2.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4998 -2.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6194 -1.9164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3148 -0.4476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8905 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7708 -0.9753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4344 0.5505 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.4326 -0.5691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4363 1.6702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5541 1.5487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.2495 3.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3691 4.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7934 3.5451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0980 2.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9784 1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0948 1.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4564 -1.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9436 -1.3086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1206 -6.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1339 -9.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5426 -9.2641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5559 -6.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0456 -2.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5562 -2.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8433 -5.0266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3538 -4.7133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2878 -1.7966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7435 -4.0896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7588 -2.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6468 1.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6314 -0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1346 2.5734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6186 4.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4272 4.7591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9377 5.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2129 2.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7289 1.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4098 0.0214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9203 0.3347 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 60 1 0 0 0 0 37 61 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 M END