MMs02813497 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 1.2931 -0.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0206 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6099 1.4794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 -0.7808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0411 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 6.5009 0.6986 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 1.2638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2165 2.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4768 3.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9357 -1.3460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4356 -1.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1959 -0.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6958 -0.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4355 -1.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6753 -2.6747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1753 -2.6628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4151 -3.9559 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9151 -3.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1548 -5.2608 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.4561 1.2163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6082 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6082 -1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5145 -1.6734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0571 -1.6856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8098 1.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6194 2.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4099 1.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8816 -1.9808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1297 1.7783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1419 3.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5208 4.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8851 4.9058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4329 3.2701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6041 0.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6355 -1.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2671 -3.7187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4906 0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0643 2.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4217 1.8245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 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 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END