MMs03910535 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 1.4943 -0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7421 1.3484 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0527 2.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2256 1.5699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8947 0.2274 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4947 -0.8118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8247 -0.8238 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2372 0.8965 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0858 1.7450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5681 2.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0443 3.6614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6596 0.4203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7832 1.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4844 2.8840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2056 0.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3292 1.9316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7516 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8752 2.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2976 1.9730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5965 0.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4729 -0.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0505 -0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6909 2.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7614 2.0431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6992 -1.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1048 1.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1954 0.1048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1048 -1.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8987 -0.7557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6329 -0.1166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1447 0.1907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3902 2.6788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9020 2.9861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6362 3.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1965 2.7680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7344 0.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7119 -1.6666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1516 -0.8095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3184 -0.7669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0631 -2.4205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7167 -2.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 3.8638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 4.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 24 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 43 44 1 0 0 0 0 M END