RDKit 3D 101105 0 0 0 0 0 0 0 0999 V2000 -0.9615 2.1792 3.6449 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5344 2.5884 2.3523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1068 3.6237 1.7997 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5588 1.7885 1.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1079 2.2143 0.5013 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5460 2.7051 0.7926 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1808 1.6458 1.4167 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2548 3.1008 -0.4588 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8826 4.3489 -0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0524 2.0133 -1.4925 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7317 2.3673 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1599 3.4719 -3.4028 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7136 1.7221 -1.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2626 1.1010 -0.4876 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0691 0.4627 -0.6958 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1205 -0.9080 -0.5070 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1154 -1.6952 -1.8138 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4758 -3.0854 -1.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3288 -3.8212 -2.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6185 -5.1566 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7152 -5.7040 -1.9382 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6284 -5.8933 -0.8185 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 -5.0776 -0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8519 -3.6396 -0.2133 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7786 -3.6955 0.9863 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6431 -2.8054 0.2221 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5160 -2.9656 -0.6765 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3293 -1.8229 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2257 -0.5402 -0.2581 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0686 0.5414 -1.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4397 -0.3845 0.6174 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7763 0.9264 1.2140 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8268 0.7211 2.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 1.9937 0.2842 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4254 1.8474 -0.5165 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7251 1.6940 0.1879 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8844 1.5941 -0.8397 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9024 2.8487 -1.6606 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1488 1.5987 0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2113 0.4621 0.8119 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0616 -1.3684 1.7728 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6489 -0.9262 2.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0714 -0.4960 0.7006 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0846 -1.3838 0.4461 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1238 2.3998 3.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1581 1.1146 3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4217 2.7765 4.4697 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9023 0.9330 2.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5626 3.0726 0.0942 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5298 3.5692 1.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1204 1.8239 1.6312 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3417 3.1346 -0.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6177 4.7930 -1.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5445 1.0995 -1.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8296 2.4486 -2.6656 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5781 1.5033 -3.4862 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2986 3.2106 -3.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0689 0.3954 -0.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1902 -1.0841 -0.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2248 -1.5978 -2.4103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9772 -1.3078 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8001 -3.4020 -3.0072 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1666 -6.3429 0.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3195 -6.7790 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -5.2250 -1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0299 -5.4764 0.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0516 -4.7335 1.2807 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -3.1863 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3132 -3.2593 1.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3716 -3.2398 1.2091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1724 -3.8214 -0.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0943 -3.4240 -1.6313 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4251 -2.1146 -1.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2105 -1.6028 -2.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4204 0.0965 -2.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9976 0.7526 -1.8635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4732 1.4033 -0.9861 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3095 -0.8130 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 1.3575 1.7952 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4182 1.6539 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2724 0.7220 3.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3687 -0.2093 2.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3777 2.3750 -0.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4573 2.9490 0.9484 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 1.0885 -1.3567 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5253 2.8099 -1.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8164 0.7059 0.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0019 2.5583 0.8181 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8255 0.6686 -1.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4602 2.6084 -2.6461 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3903 3.6770 -1.1514 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9422 3.2112 -1.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0888 2.5192 0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0524 1.7201 -0.6093 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 0.6838 1.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0979 -2.3660 1.3213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7301 -1.3063 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1133 -1.7760 2.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 -0.0970 2.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2729 0.5502 0.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6286 -1.4123 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 38 37 1 0 37 39 1 0 39 40 1 0 37 36 1 0 36 35 1 0 35 34 1 0 34 32 1 0 32 33 1 0 32 31 1 0 31 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 1 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 6 16 15 1 0 15 14 1 0 14 13 1 0 13 10 1 0 10 11 1 0 11 12 1 0 10 8 1 0 8 9 1 0 8 6 1 0 6 7 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 29 31 1 0 5 14 1 0 29 43 1 0 26 44 1 0 24 18 1 0 38 90 1 0 38 91 1 0 38 92 1 0 37 89 1 6 39 93 1 0 39 94 1 0 40 95 1 0 36 87 1 0 36 88 1 0 35 85 1 0 35 86 1 0 34 83 1 0 34 84 1 0 32 79 1 1 33 80 1 0 33 81 1 0 33 82 1 0 31 78 1 6 41 96 1 0 41 97 1 0 42 98 1 0 42 99 1 0 43100 1 1 44101 1 1 16 59 1 1 17 60 1 0 17 61 1 0 19 62 1 0 22 63 1 0 22 64 1 0 23 65 1 0 23 66 1 0 25 67 1 0 25 68 1 0 25 69 1 0 26 70 1 1 27 71 1 0 27 72 1 0 28 73 1 0 28 74 1 0 30 75 1 0 30 76 1 0 30 77 1 0 14 58 1 1 10 54 1 1 11 55 1 0 11 56 1 0 12 57 1 0 8 52 1 1 9 53 1 0 6 50 1 1 7 51 1 0 5 49 1 6 4 48 1 0 1 45 1 0 1 46 1 0 1 47 1 0 M END