IFLAB-ZINC04940828 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7040 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0760 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7970 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0790 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2280 -2.5420 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -4.5690 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1310 -0.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -5.9080 -1.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.8590 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.5440 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -8.3150 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9940 -8.5220 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -8.6400 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -9.1430 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -9.1710 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -8.4630 0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -10.0840 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -10.3160 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -11.2290 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -11.9350 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -11.7190 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -10.8120 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -10.2510 0.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -11.3330 -0.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -9.5250 0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6070 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1400 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -6.1600 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -8.0240 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -9.6930 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -8.4340 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -9.7740 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -11.3970 5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -12.6490 4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -12.2640 2.8030 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 M END