D04TLJ -OEChem-04152110132D 117118 0 1 0 0 0 0 0999 V2000 6.3301 0.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1263 1.3929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4321 1.0328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1478 4.3785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2089 2.4733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 2.3200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6126 2.7312 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2678 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0499 3.7604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6952 3.8115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7322 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6551 2.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7322 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9641 3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2322 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6615 3.0402 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9184 2.3711 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2242 2.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9673 2.6801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4536 4.0183 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 0.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1968 4.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5026 4.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3557 3.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3068 3.0913 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8205 1.7530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5147 2.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9888 5.6656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0773 1.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4657 1.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7715 1.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7441 4.1205 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0010 3.4514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5362 5.0987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2794 5.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5852 5.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4383 4.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9031 2.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2215 1.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0887 2.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3451 1.7830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 3.8876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3576 3.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5706 3.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8993 3.8876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1223 3.4551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5080 2.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2584 3.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4788 3.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3247 4.6248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 1.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 0.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5253 4.1617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7716 4.9197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6941 4.9170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9129 4.5190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3110 3.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1779 3.6977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 1.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9494 1.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4269 1.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 -0.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 -0.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9250 2.3047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5953 5.7945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8599 6.2721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3824 5.5367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8858 0.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6670 0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2689 1.6736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9210 4.3669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.1601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2742 1.2145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0554 1.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6573 2.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3567 1.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3108 1.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1864 0.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2049 4.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4073 5.7051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.1852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6942 5.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7401 6.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8645 6.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7767 5.9974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9955 5.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3936 4.8181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8532 4.0199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8991 4.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0235 4.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2966 2.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0320 2.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5095 2.9623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14 1 1 6 0 0 0 1 30 1 0 0 0 0 19 2 1 6 0 0 0 2 33 1 0 0 0 0 3 20 2 0 0 0 0 4 25 2 0 0 0 0 5 27 2 0 0 0 0 6 38 2 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 7 20 1 0 0 0 0 18 8 1 6 0 0 0 8 27 1 0 0 0 0 8 29 1 0 0 0 0 9 25 1 0 0 0 0 9 34 1 0 0 0 0 9 84 1 0 0 0 0 28 10 1 1 0 0 0 10 38 1 0 0 0 0 10 88 1 0 0 0 0 37 11 1 6 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 51 1 1 0 0 0 13 15 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 17 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 23 1 6 0 0 0 17 25 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 59 1 0 0 0 0 19 21 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 1 0 0 0 22 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 32 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 28 1 0 0 0 0 28 31 1 0 0 0 0 28 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 31 35 1 0 0 0 0 31 36 1 0 0 0 0 31 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 33 85 1 0 0 0 0 33 86 1 0 0 0 0 33 87 1 0 0 0 0 34 40 1 0 0 0 0 34 89 1 0 0 0 0 34 90 1 0 0 0 0 35 91 1 0 0 0 0 35 92 1 0 0 0 0 35 93 1 0 0 0 0 36 94 1 0 0 0 0 36 95 1 0 0 0 0 36 96 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 97 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 39 98 1 0 0 0 0 40 43 1 0 0 0 0 40 99 1 0 0 0 0 40100 1 0 0 0 0 41101 1 0 0 0 0 41102 1 0 0 0 0 41103 1 0 0 0 0 42104 1 0 0 0 0 42105 1 0 0 0 0 42106 1 0 0 0 0 43 46 2 0 0 0 0 43 47 1 0 0 0 0 44107 1 0 0 0 0 44108 1 0 0 0 0 44109 1 0 0 0 0 45110 1 0 0 0 0 45111 1 0 0 0 0 45112 1 0 0 0 0 46 48 1 0 0 0 0 46113 1 0 0 0 0 47 49 2 0 0 0 0 47114 1 0 0 0 0 48 50 2 0 0 0 0 48115 1 0 0 0 0 49 50 1 0 0 0 0 49116 1 0 0 0 0 50117 1 0 0 0 0 M END $$$$