MMs01431155 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 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 1.4323 -0.4456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9137 -1.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4136 -1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8592 -0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6347 0.4513 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2798 0.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5732 1.5373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -0.9233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8277 -0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9549 -1.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6615 -2.9026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3756 -0.9502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5028 -1.9398 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3513 -2.7883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2094 -3.4108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9235 -1.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2169 0.0126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0507 -2.4480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4713 -1.9666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5986 -2.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0192 -2.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3126 -1.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1854 -0.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7648 -0.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7333 -0.5224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.8605 -1.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2812 -1.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5746 0.4404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4474 1.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0267 0.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3565 1.1458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1458 0.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3565 -1.1458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2206 -2.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -2.8093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1723 -2.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2511 0.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7640 0.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0326 -3.1761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9746 -4.5876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3862 -3.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8159 -3.6248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3638 -4.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9210 -3.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4202 1.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8630 0.2961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9243 -2.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4371 -2.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.4631 -2.2168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4809 -1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3836 2.1806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8708 2.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8270 0.9754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8448 2.1347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END