MMs02403778 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 60 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 -0.7453 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0108 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6000 1.0284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2547 1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7547 1.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2453 -1.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4906 -2.6143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7453 -1.3234 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1453 -0.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7452 -1.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2452 -1.3397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2546 1.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7546 1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4999 -0.0488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2452 -1.3505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7452 -1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4905 -2.6577 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.2546 1.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7546 1.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5093 2.5385 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4906 -2.6251 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7359 -3.9215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4812 -5.2232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2359 -3.9161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 -0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5962 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4547 -1.3017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0277 -3.2018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6131 -3.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0464 -1.9943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0326 -2.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3714 -1.7217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1037 1.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3738 0.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7126 1.1539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1415 -2.3713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8415 -2.3811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8584 2.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1584 2.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1161 -1.7568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4493 -2.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6432 -0.7647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8743 -0.9496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1285 1.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4672 2.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6483 0.6516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8807 0.8277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6906 -2.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2316 -5.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0359 -3.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2402 -2.7161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 2.5872 0.0000 O 0 5 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 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 60 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 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 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M CHG 1 60 -1 M END