IFLAB-ZINC02723360 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -0.0440 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 -1.2500 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -2.5350 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -2.0120 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 -3.8960 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 -4.3240 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 -3.5200 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8150 -5.8000 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6120 -6.0510 -0.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 -7.8580 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 -8.2340 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0800 -7.3680 -0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 -9.5320 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0110 -9.9230 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2410 -10.9480 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2900 -12.0070 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9290 -11.5920 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 -10.6000 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 1.0270 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -4.5390 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 -6.2630 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 -6.2540 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 -8.2700 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 -8.2610 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2590 -10.3680 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6350 -9.0460 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2500 -11.3530 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1180 -10.4640 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -12.4610 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 -11.1110 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 -10.1720 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 -11.1140 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END