MMs01453718 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2447 1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4895 2.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0105 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7552 1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7657 3.8941 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7447 1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6215 2.5313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0499 2.0735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 0.5735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6313 0.1042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1735 -1.3242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2731 -0.3033 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6409 0.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -0.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7072 -2.0568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2258 0.0512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4429 -0.8255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8108 -0.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0278 -1.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3957 -0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6128 -1.3478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4620 -2.8402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0941 -3.4558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8771 -2.5791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5958 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1042 -1.0307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0853 3.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9552 1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9801 -2.2127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0008 -1.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9659 1.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5007 1.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3464 1.2452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5831 -1.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1180 -1.8177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1357 0.7822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6706 0.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5163 0.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1344 -0.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7676 -1.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.6587 -2.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7570 -4.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7692 -4.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2343 -4.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7222 -2.2530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3554 -3.6597 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 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 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END