SIAL-ZINC02560662 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 0.4350 0.3190 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 0.0190 -0.7920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6910 0.9040 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.5230 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.5230 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 0.1330 -0.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -0.3700 -0.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3860 -1.1170 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -0.9880 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -2.0840 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -1.5320 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -1.0320 -4.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 0.7830 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 1.9410 -0.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.7000 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 1.0750 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.5720 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 1.0390 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -1.4260 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -0.1960 -2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -2.6850 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -2.7710 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -1.6390 -3.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.4430 0.4330 0.1700 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0710 -1.0160 -1.6750 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2520 -1.8960 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.7180 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -1.3140 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 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 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 24 -1 M CHG 1 25 1 M END