MMs00452062 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.3042 0.7411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9022 0.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 2.2232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5002 0.7053 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9406 -1.5464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4056 -1.8683 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1645 -0.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1685 0.5471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6574 -0.4279 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0574 0.6113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5307 -1.6475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0235 -1.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7824 -0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2475 -0.5291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1447 0.2678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3940 -2.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0195 -2.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8525 -4.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0599 -5.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4344 -4.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6014 -2.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5928 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -0.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5928 -1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5392 1.6656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0818 1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4184 -0.9496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -0.9602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4485 -2.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 -2.8033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3019 0.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7529 -4.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9263 -6.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4003 -5.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7010 -2.4313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4711 1.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2769 0.9381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5782 1.9138 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 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 M END