RDKit 3D 100103 0 0 0 0 0 0 0 0999 V2000 1.2331 -5.0441 4.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0819 -5.5231 3.2144 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6449 -5.3605 1.9272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3263 -5.0927 1.5586 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0018 -4.9200 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3795 -4.5772 -0.2332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7688 -4.6961 -1.3835 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -4.0559 0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3189 -3.4054 0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5609 -2.1727 1.3278 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7358 -2.5923 2.6852 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7337 -1.3476 0.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2126 -0.5162 -0.2435 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7799 -0.4305 -0.0821 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3081 0.9131 -0.0703 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7066 1.6223 -1.2523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8299 2.8734 -1.4315 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5764 2.4697 -2.0236 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3368 3.5578 -2.1975 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5402 3.0720 -2.8086 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7329 3.5704 -2.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8287 3.5586 -3.2572 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1564 2.7341 -1.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7479 1.4813 -0.7479 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1322 0.6343 0.4606 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8005 1.5227 1.3857 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1451 -0.5251 0.0722 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6679 -1.4038 -1.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5189 0.0608 -0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3954 -1.4428 1.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1151 -1.9412 1.9661 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4614 -2.6630 3.1462 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1895 -0.7989 2.3676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8237 0.0889 1.1667 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9068 1.2268 1.6533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0688 -0.7193 0.2506 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2721 4.5984 -3.1584 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5794 5.7390 -3.3536 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6063 5.0802 -2.6029 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2415 5.9730 -3.5341 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 3.8956 -2.3374 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7385 4.3848 -1.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4725 -1.1034 1.2615 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1482 -1.6132 1.3919 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9834 -5.0418 -0.7893 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3007 -5.3131 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3634 -5.4295 -1.2917 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1043 -5.1618 -2.6665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6163 -5.4704 0.9241 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9282 -5.6845 1.2763 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9369 -4.0036 4.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3561 -5.6894 4.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -5.0807 5.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.0167 2.3076 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1209 -4.1368 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3187 -3.1139 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4672 -3.2346 2.7164 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5509 -1.9613 0.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1521 -0.6997 1.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -0.9667 -0.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6035 0.9724 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7593 1.8962 -1.1269 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6274 3.3053 -0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5514 3.9996 -1.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5828 4.6064 -1.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5342 4.1747 -4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7756 3.9430 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9963 2.5465 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8631 3.2120 -0.3446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0479 1.0050 -1.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1187 1.0034 2.1404 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7369 -1.9342 -0.9044 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5256 -0.8150 -2.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4145 -2.1725 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9665 0.6661 0.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2315 -0.7396 -0.5807 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4334 0.6883 -1.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -0.9208 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0057 -2.3098 1.0118 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5787 -2.6221 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7157 -3.5659 2.8657 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6485 -0.2102 3.1721 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2843 -1.2374 2.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0305 0.8255 2.1751 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5134 1.8094 0.8139 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4225 1.9046 2.3405 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2091 -0.9330 0.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4271 4.1565 -4.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3658 5.3967 -3.8196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4578 5.6661 -1.6872 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 6.6074 -3.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8116 3.4307 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0082 5.1446 -2.2966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5983 -0.3817 2.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1849 -2.2103 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6947 -4.9012 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4102 -5.8976 -3.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0513 -5.2510 -3.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7346 -4.1409 -2.8083 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4096 -5.7730 0.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 49 50 1 0 22 21 1 0 46 47 1 0 27 29 1 6 47 48 1 0 23 24 2 0 5 6 1 0 31 32 1 0 6 7 2 0 24 25 1 0 6 8 1 0 34 35 1 0 25 27 1 0 25 26 1 1 25 34 1 0 27 30 1 0 49 46 2 0 30 31 1 0 46 45 1 0 31 33 1 0 45 5 2 0 19 37 1 0 37 39 1 0 39 41 1 0 41 17 1 0 17 18 1 0 18 19 1 0 41 42 1 0 39 40 1 0 37 38 1 0 33 34 1 0 5 4 1 0 4 3 2 0 3 49 1 0 10 43 1 0 43 14 1 0 14 13 1 0 13 12 1 0 12 10 1 0 27 28 1 0 14 15 1 0 3 2 1 0 43 44 1 0 21 23 1 0 10 11 1 1 2 1 1 0 10 9 1 0 9 8 1 0 16 15 1 0 21 20 1 0 34 36 1 6 17 16 1 0 19 20 1 0 22 66 1 0 22 67 1 0 22 68 1 0 21 65 1 1 23 69 1 0 24 70 1 0 30 78 1 0 30 79 1 0 31 80 1 6 33 82 1 0 33 83 1 0 28 72 1 0 28 73 1 0 28 74 1 0 29 75 1 0 29 76 1 0 29 77 1 0 32 81 1 0 35 84 1 0 35 85 1 0 35 86 1 0 26 71 1 0 45 96 1 0 4 54 1 0 1 51 1 0 1 52 1 0 1 53 1 0 50100 1 0 48 97 1 0 48 98 1 0 48 99 1 0 19 64 1 1 41 92 1 6 42 93 1 0 39 90 1 1 40 91 1 0 37 88 1 6 38 89 1 0 16 61 1 0 16 62 1 0 17 63 1 1 43 94 1 1 14 60 1 6 12 58 1 0 12 59 1 0 44 95 1 0 11 57 1 0 9 55 1 0 9 56 1 0 36 87 1 0 M END