MMs01063677 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3466 -0.6607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6036 -2.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0885 -2.3508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7493 -1.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6727 0.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2271 -0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1886 -1.8985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6664 -1.6416 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9234 -3.1194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4094 -0.1637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1442 -1.3846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6606 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1384 0.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0998 -0.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5835 -2.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1057 -2.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7633 -3.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0089 -2.3693 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.3194 -3.5285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5988 -0.9265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5251 0.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0100 0.0411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9665 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4172 -2.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5286 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0773 0.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5286 -1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.9998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6494 -3.4117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8193 0.3814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2677 -0.1497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7755 -3.0252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8914 0.9448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5515 1.4074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6926 -3.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9277 -4.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5325 -4.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0801 2.0924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5195 2.7591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8528 1.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0041 -4.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5438 -3.2988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8303 -1.7590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END