IFLAB-ZINC02713669 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 0 0 0 0 0 0999 V2000 0.1230 1.0720 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.9330 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 1.5110 3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.2550 3.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 1.8680 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 1.2900 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 1.7020 4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 3.0730 5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 4.0270 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 5.3430 4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 5.7510 5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 4.8400 6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 3.4800 6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 1.2990 6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 0.8210 5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -0.8980 5.2510 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -1.2810 4.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -1.5140 6.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -1.0730 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.0300 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -1.1670 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -1.3480 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -1.3910 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -1.2590 3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 -1.5200 -0.1010 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 7.0640 6.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 7.9160 5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 7.6270 4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 6.2510 3.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.0100 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.3340 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 1.5410 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.1470 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.1460 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.0370 4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 2.5860 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 1.6540 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 2.9460 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 0.2160 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.7640 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 3.7210 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 5.1660 7.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 0.6030 7.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -0.8880 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -1.1330 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -1.5320 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 -1.2980 4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 8.9590 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 7.7110 6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 7.8190 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 8.2630 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.5460 1.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 2.5730 7.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 52 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 53 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END