MMs01580876 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 -1.2958 0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2892 2.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0131 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3023 0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6112 2.9886 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 3.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8873 2.2670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1830 3.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1765 4.5226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4853 2.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4919 0.7784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0899 0.7897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0834 2.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7811 3.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.0454 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.1365 1.3477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6479 -1.2569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6945 -0.6989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9903 0.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2926 -0.6876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6602 -0.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6688 -1.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9244 -2.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4559 -2.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3376 0.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3389 0.1398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8096 3.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3523 3.9339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4553 0.1738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7994 -1.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1200 2.8942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7758 4.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6997 -1.8989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2149 0.9726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7576 0.9793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9046 1.1033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8616 -1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4173 -3.5783 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 M END