MMs01605175 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 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 1.3160 0.7198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5974 -0.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5627 -1.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -2.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1601 -1.6197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1948 -0.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 0.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4414 -2.3996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7575 -1.6798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0388 -2.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0041 -3.9592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3548 -1.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6362 -2.5197 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9522 -1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1435 -0.3122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5304 -3.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6175 -0.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3373 -1.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3081 -2.4416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8369 -1.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6167 -0.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8969 1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3973 1.2470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.1163 -0.1384 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5758 1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0528 -0.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5758 -1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5099 -2.1355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8163 -3.5392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2476 0.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9412 1.8594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -3.3007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1913 -3.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 -0.4801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6050 -0.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1472 -0.8387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4127 -2.4379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5208 2.2374 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 24 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 M END