MMs01177667 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 0.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 0.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 0.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4854 2.2781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8006 -1.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5049 -2.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0049 -2.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7605 -3.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 0.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3987 -1.4550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 0.8005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8383 2.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 2.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9084 3.9841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0598 1.3154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0609 0.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5522 1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4287 2.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9211 2.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5371 0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6607 -0.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1683 -0.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2918 -1.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2767 -1.7206 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5205 1.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0631 1.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8307 -0.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3734 -0.9047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1185 1.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6612 1.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8124 -0.4388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9714 -0.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9815 -1.2528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2159 -2.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3534 -3.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8981 -1.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -2.6437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6831 -4.2915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8446 -4.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3146 1.7052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8573 1.7119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6383 2.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7077 3.4859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4654 -0.8454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5479 -0.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9358 3.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6223 3.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7311 0.7441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8049 -1.0693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5907 -2.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2657 -2.1211 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 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 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 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 M END