IFLAB-ZINC04374953 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.9790 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.4180 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8900 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3160 -2.1650 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.5000 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.4810 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -1.6310 3.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -2.0620 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -3.4490 4.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -4.2580 5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -5.5030 5.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -5.5790 3.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -4.3120 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -3.7890 2.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -6.8080 3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -1.1710 5.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 0.2670 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 1.0130 6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 1.4350 6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 2.1190 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 2.3810 8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 1.9600 8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.2800 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.0900 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.2100 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -2.0260 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.5070 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -2.2240 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.1240 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -3.5850 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -3.9040 6.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -7.1810 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -6.5980 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -7.5590 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -1.4980 6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 0.5920 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 0.4730 5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 1.2300 5.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 2.4480 7.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 2.9150 9.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 2.1650 9.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.9540 7.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 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 1 0 0 0 0 22 44 1 0 0 0 0 22 45 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 50 1 0 0 0 0 M END