OTAVA-ZINC04514045 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 1.8170 1.0510 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -0.1540 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -0.6530 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.7610 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -2.3770 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.8830 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.7580 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.2540 -2.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -0.6940 -3.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8300 0.0840 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.0820 -4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.3040 -5.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -2.3490 -4.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -3.1740 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -4.3490 -4.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.2460 -2.5370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.8340 -6.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -2.4470 -7.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.9270 -8.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -3.7910 -8.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -4.1770 -7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -3.7060 -6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.5370 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -2.0490 -2.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 0.7240 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.6260 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 1.6730 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -0.1780 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.1430 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -3.2400 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.7520 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -1.7720 -7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -2.6270 -9.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -4.1650 -9.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -4.8520 -7.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -4.0110 -5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -3.6770 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -4.0690 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 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 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 37 38 1 0 0 0 0 M END