MMs00039783 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 70 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 1.2987 0.7506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5988 -1.4988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 -2.2482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 -1.4975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8968 0.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 -2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -3.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7964 -4.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 -3.7457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0943 -2.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7949 -1.4963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3930 -1.4951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6924 -2.2445 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6924 -1.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8499 -3.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3173 -4.0473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0667 -2.7479 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6667 -3.7872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0624 -1.6337 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7519 -0.4746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8118 -0.3343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2792 -0.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4367 -2.1372 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.2852 -1.2887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7361 -2.8866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0348 -2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0341 -0.6360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3342 -2.8853 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6328 -2.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9322 -2.8841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2309 -2.1335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2302 -0.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9308 0.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6321 -0.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9301 1.6159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.2288 2.3665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5303 -2.8829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.8290 -2.1323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6005 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 -0.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6005 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5598 -2.0993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 -3.4482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2351 0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8962 1.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 -4.3474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7969 -5.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3924 -0.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6499 -3.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -4.9296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4041 0.5480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4792 -0.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7367 -4.0866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3347 -4.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9328 -4.0841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2692 -0.0330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5926 -0.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8293 1.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2677 2.9670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6283 3.4055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4295 -3.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.8679 -1.5318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.2285 -1.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 40 1 0 0 0 0 35 36 2 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 37 60 1 0 0 0 0 38 39 1 0 0 0 0 39 61 1 0 0 0 0 39 62 1 0 0 0 0 39 63 1 0 0 0 0 40 41 1 0 0 0 0 41 64 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 M END