IFLAB-ZINC04316704 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.4390 1.5170 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.0110 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.5980 1.6340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -2.3490 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -3.1630 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -4.5260 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -5.0970 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.2770 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.9150 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -6.5620 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -7.2740 2.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -7.1110 -0.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -8.4970 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -9.2840 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -10.6560 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -11.2570 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -10.4910 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -9.1030 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -8.2770 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -8.7650 -3.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -9.7000 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -7.6780 -4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -7.5360 -5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -6.2740 -6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -5.1470 -5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -5.2670 -4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -6.5360 -3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -6.9660 -2.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 1.8390 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 1.8690 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.9300 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.3340 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.4250 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.7220 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -5.1570 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -4.7150 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.2800 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -6.5420 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -8.8220 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -11.2640 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -12.3320 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -10.9640 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -8.4090 -6.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -6.1630 -6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -4.1660 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -4.3830 -3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 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 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 M END