IBS-ZINC01260931 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 0 0 0 0 0 0999 V2000 1.0370 1.6720 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 0.4390 -1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.3300 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -0.9210 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.0300 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -2.5740 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -3.9390 -2.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -4.3970 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -3.7360 -4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -4.5100 -5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -5.9220 -4.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -6.6060 -4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -5.8140 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -6.1500 -2.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -5.0260 -2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -5.3150 -1.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -6.7090 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -7.2450 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -7.4690 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -8.8520 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -9.5760 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -8.8970 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 -7.5540 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -6.8150 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -7.0770 1.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 -8.2750 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -9.4340 1.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 2.1520 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 1.4220 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 2.4080 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 0.6620 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 0.0110 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.7390 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 0.7550 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.0100 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -0.5070 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.6850 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -1.9950 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.6710 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -1.9470 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -2.5260 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.6570 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -4.0150 -5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -6.4820 -5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -7.6860 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -8.2520 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -9.3870 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -10.6360 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -5.7560 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 -8.4780 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 -8.1040 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -0.6120 -1.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9460 -0.5550 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 52 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 46 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END