PUBCHEM-ZINC02972702 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.4900 -6.7370 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -5.6230 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -4.5780 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -3.5480 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -3.5240 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -4.5640 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -5.6180 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -6.6950 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -6.6330 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -2.2830 0.0290 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -1.3320 0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -1.8800 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -3.1510 0.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -3.8080 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -4.4060 3.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0630 -3.5810 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -5.3430 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -5.1090 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -5.9630 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7510 -7.0320 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -7.2950 0.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -6.4520 1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -5.8550 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -6.5940 6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -5.6850 7.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -4.8260 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -4.0920 5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -5.7130 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -4.5520 9.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -4.5850 10.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -5.7880 11.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -6.9540 10.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -6.9120 9.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -6.7920 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -7.6930 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -6.5800 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -4.5760 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -2.7170 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -4.5290 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -6.6650 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -7.5160 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -5.7480 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -3.6300 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -4.6020 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -3.0560 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -4.2600 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4540 -5.7960 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 -7.7260 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -6.7130 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -6.5900 4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 -5.1230 5.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -7.0570 6.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -7.4010 6.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -4.0860 7.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -5.4590 6.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -3.3780 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -3.5730 4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -3.5840 8.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -3.6670 11.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -5.8160 12.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -7.9010 11.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -7.8520 8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -5.0830 4.3620 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1710 -5.7700 4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 63 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END