D0WJ1N -OEChem-04152122332D 111113 0 1 0 0 0 0 0999 V2000 6.3981 -2.8062 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 8.7993 -5.5494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1141 -4.1246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8981 -3.6722 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8981 -1.9402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6964 -4.8290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5153 -3.1065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.1938 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1301 -4.8062 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7128 -5.1426 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6301 -3.9402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6083 -4.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -4.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7073 -5.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3870 -5.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1195 -6.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1086 -4.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5099 -3.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9166 -2.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9111 -1.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3178 -1.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3124 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7191 -0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7136 0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1204 0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1149 1.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5216 1.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5161 2.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9229 3.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9174 3.1065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3241 4.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.8062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3187 4.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7254 5.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7199 5.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1267 6.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.1591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8217 -3.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0637 -3.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2283 -4.1481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6731 -3.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6535 -4.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0521 -4.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6641 -5.6566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3089 -5.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9721 -5.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9262 -5.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -5.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5532 -6.3084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3717 -6.6226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6859 -5.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1509 -2.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4666 -3.6204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1114 -3.1519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9598 -1.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3150 -1.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8679 -2.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5127 -2.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3611 -0.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7163 -0.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2691 -1.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9140 -1.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7624 0.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1175 0.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6704 -0.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3152 -0.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1636 1.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5188 1.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0716 0.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7165 0.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5649 2.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9200 2.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 -1.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 -0.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4729 1.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1177 1.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9661 3.6204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3213 3.1519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8742 2.4880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5190 2.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3674 4.6385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7226 4.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 -0.6986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.3888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2754 3.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9202 3.9746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.7686 5.6566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1238 5.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6767 4.5241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.3215 4.9926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.6931 5.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.3788 6.6226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5603 6.3084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 2.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.4608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.8138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.0267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 15 1 0 0 0 0 4 16 1 0 0 0 0 4 19 1 0 0 0 0 5 28 1 0 0 0 0 8 19 2 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 63 1 0 0 0 0 10 35 1 0 0 0 0 10 39 1 0 0 0 0 10 40 2 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 17 1 6 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 6 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 20 21 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 21 22 1 0 0 0 0 21 66 1 0 0 0 0 21 67 1 0 0 0 0 22 23 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 24 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 25 1 0 0 0 0 24 72 1 0 0 0 0 24 73 1 0 0 0 0 25 26 1 0 0 0 0 25 74 1 0 0 0 0 25 75 1 0 0 0 0 26 27 1 0 0 0 0 26 76 1 0 0 0 0 26 77 1 0 0 0 0 27 29 1 0 0 0 0 27 78 1 0 0 0 0 27 79 1 0 0 0 0 28 35 1 0 0 0 0 28 84 1 0 0 0 0 28 85 1 0 0 0 0 29 30 1 0 0 0 0 29 80 1 0 0 0 0 29 81 1 0 0 0 0 30 31 1 0 0 0 0 30 82 1 0 0 0 0 30 83 1 0 0 0 0 31 32 1 0 0 0 0 31 86 1 0 0 0 0 31 87 1 0 0 0 0 32 33 1 0 0 0 0 32 88 1 0 0 0 0 32 89 1 0 0 0 0 33 34 1 0 0 0 0 33 90 1 0 0 0 0 33 91 1 0 0 0 0 34 36 1 0 0 0 0 34 92 1 0 0 0 0 34 93 1 0 0 0 0 35 94 1 0 0 0 0 35 95 1 0 0 0 0 36 37 1 0 0 0 0 36 96 1 0 0 0 0 36 97 1 0 0 0 0 37 38 1 0 0 0 0 37 98 1 0 0 0 0 37 99 1 0 0 0 0 38 41 1 0 0 0 0 38100 1 0 0 0 0 38101 1 0 0 0 0 39 42 1 0 0 0 0 39 44 2 0 0 0 0 40 43 1 0 0 0 0 40102 1 0 0 0 0 41103 1 0 0 0 0 41104 1 0 0 0 0 41105 1 0 0 0 0 42 45 1 0 0 0 0 42 46 2 0 0 0 0 43 45 2 0 0 0 0 43106 1 0 0 0 0 44 47 1 0 0 0 0 44107 1 0 0 0 0 45108 1 0 0 0 0 46 48 1 0 0 0 0 46109 1 0 0 0 0 47 48 2 0 0 0 0 47110 1 0 0 0 0 48111 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$