IFLAB-ZINC02711054 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7110 -0.0510 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -1.9980 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -2.5360 -0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -2.7660 -2.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -2.4030 -3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -3.2720 -4.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.9740 -4.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6100 -0.5450 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -0.0370 -2.7310 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -0.9210 -5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 0.5160 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -4.2030 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -4.8290 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -4.1420 -1.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -6.1520 -1.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -6.7610 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -8.2390 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -8.7150 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -10.0710 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -10.9520 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -10.4760 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -9.1210 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -1.5690 -6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.2590 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.1640 -5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 0.8550 -6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 0.5540 -6.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -4.6620 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -4.3610 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -6.7020 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -6.3020 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -6.6030 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -8.0260 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -10.4420 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -12.0110 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -11.1650 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -8.7500 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 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 45 1 0 0 0 0 M END