IFLAB-ZINC02965926 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 1.0080 0.6030 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0050 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.5040 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 0.3400 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -0.1100 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.4220 3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -2.2680 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -1.8060 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -1.8750 4.5760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1930 -2.0510 5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -2.4560 6.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -2.4260 8.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.4090 8.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.3450 7.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.8460 6.1280 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -2.9250 5.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1570 -2.2430 4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -2.4650 6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -3.0660 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -2.4600 7.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 -1.3670 8.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -1.0490 7.7310 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -4.3470 5.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.1570 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.9640 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 1.4330 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 0.7540 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -0.8350 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 1.3540 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 0.5490 4.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -3.2830 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.4600 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -3.3050 8.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -1.5370 8.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -3.3870 8.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -2.2140 9.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -1.2570 8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -0.3870 7.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -2.9380 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -1.3540 4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 -3.9570 6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7630 -2.8430 7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 -0.7670 8.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -4.7040 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 23 44 1 0 0 0 0 M CHG 1 9 1 M END