MMs01679277 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.7486 -1.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 -1.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9972 -2.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -3.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7458 -3.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0028 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5028 -2.5964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3832 -1.3820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8103 -1.8439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8119 -3.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3858 -3.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0264 -4.2243 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 -3.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6105 -4.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4554 -5.9850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9802 -3.8815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1947 -4.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5643 -4.1502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7788 -5.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6236 -6.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2540 -7.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0395 -6.2538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8381 -7.4029 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.1485 -4.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7195 -2.6583 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5989 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 -0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8497 -0.2629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1972 -2.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8446 -4.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1446 -4.9365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7239 -2.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2583 -2.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1043 -2.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1298 -8.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6592 -3.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2442 -3.9297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6377 -5.5147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END