CHEMSTAR-ZINC04016483 MOE2007 3D CORINA 3.40 0006 02.08.2006 87 89 0 0 1 0 0 0 0 0999 V2000 0.0190 1.5150 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -0.0110 0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0920 -0.3100 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.5200 1.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8780 -0.2530 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -2.0180 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.5100 2.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -2.8120 0.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 0.0920 2.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 1.3060 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 1.8930 2.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 1.9350 4.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5780 2.0600 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.0310 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 1.5980 6.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 1.2210 7.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 1.7380 8.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.6380 8.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 3.0140 8.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.4890 7.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 3.1490 10.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 4.0690 10.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 4.5260 12.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 3.8270 13.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 4.2460 14.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 5.3650 14.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 6.0650 13.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 5.6480 12.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.2430 4.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 4.3340 3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 4.2330 3.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 5.6800 3.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6520 5.7820 4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 5.7970 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 7.0900 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 7.1280 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 8.3140 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 9.4620 3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 9.4230 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 8.2360 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 6.7380 3.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 6.8100 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 5.9970 1.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 7.7820 2.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 7.7980 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 6.4820 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 8.9650 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 7.9650 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.5700 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.8140 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.8770 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.9410 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -2.4200 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -3.7740 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -0.3780 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.0320 5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.9780 5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 0.5210 6.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 1.4440 8.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 3.7140 9.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 2.7790 6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 3.5790 11.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 4.9300 10.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 2.9530 13.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 3.6990 15.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 5.6920 15.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 6.9380 13.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 6.1970 11.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 3.3240 4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 4.9590 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 5.7830 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 6.2320 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 8.3440 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 10.3880 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 10.3190 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 8.2050 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 7.3860 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 6.3630 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 6.4940 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 5.6510 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 9.9020 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 8.9770 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 8.8460 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 7.1340 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 7.9780 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 8.9030 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -1.5280 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 59 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 22 63 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 64 1 0 0 0 0 25 26 1 0 0 0 0 25 65 1 0 0 0 0 26 27 2 0 0 0 0 26 66 1 0 0 0 0 27 28 1 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