MMs01238646 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -1.2938 -0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6084 1.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3146 2.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0104 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9126 2.2229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2064 1.4639 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4474 0.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9654 2.7577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5002 0.7049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4898 -0.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7836 -1.5541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0878 -0.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0983 0.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8045 1.4459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4025 1.4278 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6615 2.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1434 0.1236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7067 2.1688 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0005 1.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3047 2.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5985 1.3918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5881 -0.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2839 -0.8492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9901 -0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3816 -1.5721 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0434 -0.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2855 -1.9590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6331 -0.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 3.4409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0246 2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 3.4229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 -1.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7753 -2.7540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8128 2.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7150 3.3688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3130 3.3507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6419 1.9845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6231 -0.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2755 -2.0491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9467 -0.6829 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 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END