MMs00245987 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7388 -1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2388 -1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9776 -2.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4775 -2.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2387 -1.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7386 -1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6307 -0.1510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0532 -0.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0404 -2.1267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6098 -2.5779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2743 0.2445 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.2350 0.8445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1303 1.7376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3513 2.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7164 1.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8603 0.4939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6393 -0.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2254 -0.1279 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.6035 -1.4930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.8472 1.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5904 -0.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7344 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0994 -2.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3205 -1.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1765 -0.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8115 0.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0443 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4612 -1.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0118 -3.2069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6312 -3.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0563 -1.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3687 -3.6578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0686 -3.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1087 0.9954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4088 1.0186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9740 1.4167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6135 2.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4953 3.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0309 3.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0166 3.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9127 1.8930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9598 -1.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4953 -1.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7576 -2.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2146 -4.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4125 -2.4909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1533 0.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6963 1.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 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 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 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 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END