SIAL-ZINC02163760 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 0 0 0 0 0 0999 V2000 -0.0360 1.4650 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.0530 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -2.1060 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -2.4400 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -1.5240 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -1.8090 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 2.0880 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 3.5010 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 3.8150 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.8200 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.8210 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.4280 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.4290 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -2.4940 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -2.4560 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -3.4680 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -2.2960 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7590 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 1.8190 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.6080 0.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7910 -0.2390 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.3220 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M END