IBS-ZINC02330930 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.0970 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.7030 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.1640 -2.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -4.9160 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -4.3800 -4.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -6.3780 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -7.1630 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -8.4760 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -8.7920 -3.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -7.1380 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -6.6300 -4.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -7.4670 -4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -8.6660 -4.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -6.9260 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -7.6750 -5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -6.7550 -6.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -5.5280 -6.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -4.6850 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -5.6540 -5.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -7.0360 -7.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -8.1260 -8.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9560 -8.3840 -8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -7.5640 -8.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 -6.4810 -7.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -6.2130 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -5.1520 -6.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -9.5400 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -8.9290 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -7.6160 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -6.5680 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -2.4160 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.4330 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.3830 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.3670 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -4.5920 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -5.6730 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -8.7490 -5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -8.7680 -8.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -9.2280 -9.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9820 -7.7720 -8.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8190 -5.8450 -7.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 -4.3310 -6.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -9.8940 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -10.3730 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -9.6220 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -8.7330 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -7.7790 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 -7.2680 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 -6.2860 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -5.6890 -1.1670 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 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 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 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END