IFLAB-ZINC02457755 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -3.9960 1.5630 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 0.3650 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -0.0420 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -1.1380 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -1.8340 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -1.4160 -1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -0.3190 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -3.2140 -0.3150 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -3.3310 -1.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -3.0540 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -4.5510 -0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -4.9090 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -6.3230 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -6.4560 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -6.0550 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -4.6430 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 -6.9200 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -7.0690 -1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -7.2590 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -6.5690 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2580 -6.8950 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7650 -7.9180 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -8.6180 3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -8.2960 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4690 -8.2650 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4860 -7.5680 5.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3930 2.4690 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 1.4660 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 1.6700 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 0.4950 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -1.4340 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -1.9320 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 0.0020 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -4.1910 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.8820 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -6.5760 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -7.0540 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -6.0740 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -6.7880 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -4.4290 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -3.9090 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0090 -5.7840 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -6.3550 3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -9.4250 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -8.8550 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 -9.2290 5.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 2 0 0 0 0 M CHG 1 26 -1 M END