MMs00088372 MOE2007 2D CORINA 3.40 0006 02.08.2006 32 33 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 -0.7400 -1.3047 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3400 -0.2655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9801 -2.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0199 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5128 -2.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8359 -4.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5426 -4.9681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5798 -3.9729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0446 -4.2960 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -4.6608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -3.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8031 -4.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0499 -2.1838 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6198 -1.7312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2967 -0.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1569 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -6.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0438 -0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0238 -2.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5721 -3.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9363 -3.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -2.0572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0425 -0.3619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3472 -0.2860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4172 -6.3840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8475 -7.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7609 -5.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 20 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 19 1 0 0 0 0 17 18 2 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 M END