MMs00684799 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 55 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 -0.7548 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2548 -1.2907 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0096 -2.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5096 -2.5813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2645 -3.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5193 -5.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0193 -5.1850 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2645 -3.8887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0742 -6.5730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9792 -7.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3195 -9.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7548 -9.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8499 -8.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5095 -7.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7455 -6.1588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8511 -4.6628 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8511 -3.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7467 -3.6477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2447 -4.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6149 -2.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1117 -2.5571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6667 -3.9507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5128 -4.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6099 -6.4060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1203 -4.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1676 -3.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6212 -3.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0275 -5.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9801 -6.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5265 -5.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6564 -1.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3713 -1.7109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9676 -2.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -7.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4435 -9.8791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0271 -10.6634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9981 -8.8181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7873 -6.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6858 -6.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8427 -2.0919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4591 -2.7582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1904 -5.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3051 -7.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6886 -6.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7333 -2.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8897 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5796 -0.7337 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 M END