MMs03219714 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 51 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 1.4999 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2386 1.3186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 -1.2794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4612 -1.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5226 -2.5849 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9226 -3.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 -3.8774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7838 -3.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -5.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -5.1437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7837 -3.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0224 -2.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5224 -2.5588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7387 -1.3055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7161 -3.9035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -4.9375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -3.9165 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6160 -4.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9773 -2.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4772 -2.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2385 -1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7384 -1.3577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9547 -5.2221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4546 -5.2351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1934 -6.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9321 -7.8200 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0104 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0104 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1598 -4.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5025 -5.0573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9541 -6.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -6.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9836 -3.8278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6133 -1.5014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 -1.5248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8533 -2.2039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1959 -1.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2586 -3.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6012 -3.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1145 -0.9245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4572 -0.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5198 -2.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8625 -1.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9088 0.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2809 -5.7352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2675 -7.2778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6997 -0.0757 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 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 47 50 1 0 0 0 0 50 51 1 0 0 0 0 M END