MMs03180949 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 29 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 -1.4271 -0.4619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4288 -1.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0028 -2.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8803 -1.2145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3803 -1.2162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0697 -2.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2634 -0.0037 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1119 0.8448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6894 -0.4688 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8485 -0.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6877 -1.9688 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3771 -3.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2606 -2.4308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9002 -2.8519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -4.3435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9039 0.4115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8014 1.4234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4592 -3.8542 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.6433 -2.8422 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0130 -2.2305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4882 -4.3342 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3721 1.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4275 -1.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0534 -3.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7118 -5.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7799 1.6050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 1.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END