MMs01604862 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 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 1.2971 0.7534 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2579 1.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2932 2.2533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5903 3.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8913 2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7601 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8952 -0.4399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0067 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6019 -1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4932 0.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 2.2668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7735 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5529 -1.4645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0209 -1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7676 -0.4716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7610 0.6405 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0691 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2590 -0.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8655 1.0609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3569 1.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2417 0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6351 -1.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1438 -1.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6027 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 2.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8799 3.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8166 3.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3593 3.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2988 3.3887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0736 2.0547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4019 -1.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -2.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8019 -1.4902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1992 -1.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0252 -0.9011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5679 -0.8971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5119 -2.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2435 1.8621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3155 3.2829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8947 2.3550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1577 2.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8421 2.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4348 0.1388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3430 -2.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6585 -2.6197 0.0000 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END