MMs00025932 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 63 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 1.2942 0.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2846 2.2583 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2846 3.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 3.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5693 4.5165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8827 2.2749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1769 3.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 2.9999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3134 2.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3038 0.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6172 2.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9114 2.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2152 2.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2545 3.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2248 4.4667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2248 5.6667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9306 5.2250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8914 5.8250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6268 4.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9402 6.7249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5286 5.2084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5094 2.2084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4999 0.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -0.0332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7845 -1.5498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0787 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3825 -1.5664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3921 -0.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0979 0.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1075 2.1918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4113 2.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6767 -2.3247 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.6671 -3.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 -0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2942 -0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0047 -1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6411 -0.5767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1914 1.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7835 1.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2122 3.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5702 4.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0269 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9037 1.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4437 4.2825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2236 5.6135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9048 7.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5363 6.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5525 2.8018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7414 -2.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0710 -3.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4351 0.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8179 3.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4543 3.5268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0046 1.8905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8671 -3.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6595 -5.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4672 -3.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 M END