MMs03687513 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.3413 -0.6715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5935 0.1544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4304 -2.1688 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6942 -2.9769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5427 -3.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3163 -4.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8189 -4.5176 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2714 -3.1211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3286 -4.1603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1802 -2.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5787 -1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0303 -0.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0834 -1.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6849 -3.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2333 -3.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8348 -5.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0907 -2.4294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3149 -0.9462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2631 -3.3651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6596 -2.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 -3.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2285 -3.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4009 -4.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7975 -3.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0216 -2.1109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8492 -1.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4527 -1.7227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4181 -1.5634 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5372 1.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 0.5372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5372 -1.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5028 -4.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -5.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7362 -0.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3491 0.2378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2447 -1.6849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5274 -4.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6773 -6.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0838 -4.5516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0343 -1.7934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5597 -2.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 -4.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 -4.7775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2216 -5.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7354 -4.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0285 0.0114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5148 -0.9741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 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 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 39 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M END