IFLAB-ZINC02701919 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 1.6470 0.6960 6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -0.7610 5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -1.1420 4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -2.4770 4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -3.4360 4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -3.0520 6.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -1.7140 6.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -4.0910 7.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -4.7510 4.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -5.0740 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -6.5660 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -7.2820 4.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -7.1040 2.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -8.4770 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -9.3740 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -10.7290 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -11.1930 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -10.3020 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -8.9460 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -12.9220 1.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -13.0550 -0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -13.5000 2.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -13.5150 0.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -13.1040 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -13.5960 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -13.1550 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -12.2840 -2.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -11.8370 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -12.2290 -1.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -10.9500 -2.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -10.5540 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 -13.6070 -1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 -13.1060 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.9580 6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 0.8800 6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 1.3050 5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.3950 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -2.7740 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -1.4140 7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -4.2530 6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -3.7460 8.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -5.0260 6.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -4.7340 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -4.5800 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -6.5390 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -9.0130 3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -11.4280 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -10.6670 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -8.2520 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -14.1490 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -14.3030 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -10.0850 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -9.8430 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -11.4300 -4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -12.0220 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 -13.3660 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -13.5470 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 M END