IFLAB-ZINC04251240 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 1.1680 -0.4910 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 1.0020 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7580 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -0.3100 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -1.0140 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -2.1720 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -2.6200 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.9200 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.8840 0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 -2.2310 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.0180 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2930 -3.0070 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6850 -1.8520 0.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.0780 -2.9240 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3680 -2.3760 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4490 -3.1940 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2600 -4.5910 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1060 -5.6090 0.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4160 -6.7560 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0910 -6.4510 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9910 -5.0940 0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9000 -4.2250 0.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9930 -8.1220 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3690 -8.2960 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9000 -9.5690 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0690 -10.6710 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7020 -10.5050 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1610 -9.2360 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.1900 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.4900 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.5210 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 0.5870 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -0.6700 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -3.5190 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -2.2660 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -3.8510 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -3.6310 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -3.6380 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5000 -1.3040 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4410 -2.7790 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2760 -7.1540 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0190 -7.4360 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9670 -9.7040 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4890 -11.6660 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0580 -11.3690 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0940 -9.1080 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 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 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 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 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 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 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 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 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END