PUBCHEM-ZINC05957572 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -2.2730 1.3350 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.5240 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 3.3350 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 3.7770 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 5.2400 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 5.7360 5.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 7.1330 5.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 8.1520 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 7.9510 4.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 9.5520 5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 10.5660 4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 11.8910 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 12.2030 5.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 11.2020 5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 9.8480 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 8.8540 5.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 9.1230 6.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 8.0480 6.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0430 8.2210 6.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5660 9.4990 7.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7660 10.5910 6.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 10.4290 6.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 11.4930 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 12.8180 5.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 0.2590 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 1.8540 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 1.5190 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 2.0960 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 0.4490 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.7680 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 3.4810 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 3.8840 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 3.1470 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 3.6680 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 5.8590 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 5.3610 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 5.1810 5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 5.6090 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 7.4090 5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 10.3240 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 12.6800 4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 13.2570 5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 7.0390 6.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 7.3600 7.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5900 9.6520 7.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2140 11.5760 6.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 13.5970 5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 13.0460 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 1.8590 1.9820 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4490 1.3560 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 49 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 16 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END