MMs01367299 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.1319 -0.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8453 -2.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9772 -3.4410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3956 -2.9530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6821 -1.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5502 -0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1005 -0.9926 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2323 -1.9769 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -3.1088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -0.8451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3642 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7826 -2.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9144 -3.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 -4.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2095 -5.4180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0776 -4.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6593 -4.9217 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.7597 -5.9143 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.3328 -2.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6193 -1.4971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4646 -3.9538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8830 -3.4658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0149 -4.4501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4333 -3.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7198 -2.4897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5879 -1.5054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1696 -1.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1382 -2.0017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4247 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8431 -0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9749 -1.0256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.6884 -2.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2700 -2.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7875 0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9055 0.7875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7875 -0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2894 -2.8471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7479 -4.6190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -3.7405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7795 0.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3297 0.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0118 -1.2953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9803 -6.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2354 -5.1317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7856 -5.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3387 -4.7495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8172 -0.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2641 -1.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2249 -0.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2372 0.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2615 1.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7758 0.7138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8882 -2.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8759 -3.6832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3373 -3.7410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8516 -4.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 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 43 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 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 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 M END