MMs02813499 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 1.3018 -0.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0098 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5981 -1.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8999 -0.7354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0195 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 6.4923 0.7744 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4412 1.3157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1864 2.6176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4315 3.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 -1.2767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -1.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1961 0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6961 0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4510 -1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7058 -2.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2059 -2.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4607 -3.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9509 -1.2541 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.7058 -2.5503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6961 0.0477 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5961 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 -1.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7924 1.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5879 2.7097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3924 1.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9044 -1.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1085 1.8497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1027 3.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4684 4.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8276 4.9508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3945 3.3099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5922 1.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2922 1.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6098 -3.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4238 -4.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0646 -4.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4977 -3.2539 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 38 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END