MMs01672950 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7606 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2606 1.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2393 -1.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7393 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0213 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5213 -2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 -1.2805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2819 -3.8785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5426 -5.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3033 -6.4765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8032 -6.4642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5425 -5.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7819 -3.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0370 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5122 1.4630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4875 -1.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 -0.0493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7604 1.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2604 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2391 -1.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7391 -1.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0212 2.5734 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1692 2.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8307 -2.3616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5701 -3.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3427 -5.1935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7118 -7.5206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7425 -5.1492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3733 -2.8221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6362 1.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9785 2.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0617 2.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3914 1.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9253 0.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9126 -0.8528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3633 -1.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -2.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6081 -1.7556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9378 -2.5379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 33 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 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END