PUBCHEM-ZINC04994037 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 2.6290 -2.2600 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.6610 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -3.9340 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.2700 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -3.0930 0.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7190 -2.9090 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -1.8120 0.7540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5320 -0.9780 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -1.4780 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -1.8700 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.6420 2.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -2.1500 3.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -2.3230 4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -2.6320 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -2.8900 6.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -2.8530 7.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -2.5070 6.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.2430 5.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -3.2000 8.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -2.8560 9.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -3.9490 9.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -4.3350 10.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -5.1260 10.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -4.5090 11.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -5.2770 11.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -6.6450 11.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -7.2780 10.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -6.5050 10.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -3.5190 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -2.7510 1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -5.1500 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -3.0900 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -1.5210 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -1.8100 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -5.0920 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -4.6530 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -0.6630 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -1.0990 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -2.2790 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -2.6980 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -3.1450 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -2.4300 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.9940 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -4.2510 8.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -3.4280 11.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -4.9170 10.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.4320 11.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -4.8200 11.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -7.2870 11.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -7.0460 10.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -4.9170 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -5.8060 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -5.7130 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -4.5650 0.3490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 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 9 37 1 0 0 0 0 9 38 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 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 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 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M CHG 1 54 -1 M END