RDKit 3D 122128 0 0 0 0 0 0 0 0999 V2000 1.1998 6.3815 3.8288 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9154 6.6747 2.4614 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4124 6.8739 2.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3048 6.7772 3.0287 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5907 7.2645 0.7217 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2424 6.2268 -0.2027 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2618 5.2502 -0.4330 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5135 4.5024 0.7564 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8575 3.2279 0.8153 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6506 3.3944 1.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3745 2.0566 1.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8218 1.1384 2.2701 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2183 1.7743 3.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7339 1.0141 2.0803 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3291 0.0163 3.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7595 -1.3894 2.8868 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7939 -1.4846 2.9129 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2189 -1.3776 4.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4336 -0.3182 2.0720 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9784 -0.3806 2.1247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5584 -1.7630 2.2115 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9211 2.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6533 -4.2475 2.4093 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9377 -5.2298 3.3880 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0397 -4.6799 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8647 -3.8886 5.2486 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1529 -5.2286 5.6762 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6564 -6.5951 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -7.1949 2.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8967 -6.2284 1.3167 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3642 -6.9538 0.0453 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -4.8971 1.0448 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0364 -3.9291 0.2514 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0206 -5.2246 0.2112 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4654 -5.4097 2.9689 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6835 -4.0977 3.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3182 -2.9004 2.2740 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8829 -3.0509 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5242 2.3675 1.9394 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9816 2.0707 1.4833 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6514 3.1574 3.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5952 5.8760 -0.9156 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9099 5.5341 -2.2805 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6274 4.3024 -2.4123 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7311 3.2085 -2.2075 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3761 1.9379 -2.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 1.7667 -3.7806 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7628 1.8167 -4.6985 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8356 2.8973 -4.1312 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1863 2.8394 -5.5225 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2265 4.2708 -3.8352 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2490 5.2708 -3.9856 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5042 7.3994 -0.8897 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8044 7.9776 -1.1147 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9813 7.8649 0.4634 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9164 9.3022 0.4541 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6817 5.4728 4.1476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2764 6.2147 3.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9234 7.2278 4.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 8.0616 0.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8727 4.5946 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0251 2.7069 -0.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0766 3.9266 0.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8546 4.0422 1.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 1.5382 0.1751 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4412 2.2557 1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3031 2.8621 3.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5006 1.5708 4.4233 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1937 1.4411 3.9852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8654 0.5315 1.0968 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4135 -0.0616 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1748 0.3381 4.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1618 -1.7408 1.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 -2.0546 3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9126 -0.4356 4.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2972 -1.4658 4.5644 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7462 -2.1416 5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -0.5501 1.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3738 0.1731 2.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 0.0991 1.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6467 -1.7861 2.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6013 -3.9832 2.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3718 -4.8114 6.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0403 -7.3153 4.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5809 -6.4908 4.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5678 -8.1310 2.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -7.4654 1.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 -5.9999 1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5313 -7.1622 -0.6339 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -7.9111 0.2983 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1147 -6.3717 -0.4968 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5084 -3.0068 -0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9402 -3.6711 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3322 -4.3530 -0.7136 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8098 -4.4390 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3902 -5.8288 1.9612 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9662 -6.1392 3.6202 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5434 -3.8696 4.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3326 -4.2804 2.6651 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8821 -4.0978 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5404 -2.5065 0.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1334 -2.7060 0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5113 2.9873 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5725 1.6041 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9956 1.4011 0.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7093 3.6000 3.5774 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3613 3.9870 3.1544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0232 2.5271 4.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4306 5.5582 -0.2778 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4384 4.2734 -1.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1928 1.8542 -1.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6254 1.1763 -2.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3507 0.7943 -3.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0508 2.3364 -4.2745 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7697 2.7817 -3.5686 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3902 2.5008 -5.9837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4512 4.5111 -4.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6607 5.0907 -4.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8704 7.7783 -1.7018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1251 7.5807 -1.9503 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7041 7.6075 1.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7793 9.5893 0.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 22 37 1 0 42 53 1 0 53 55 1 0 55 5 1 0 5 6 1 0 22 23 1 0 37 36 1 0 36 35 1 0 35 24 1 0 10 11 1 0 37 38 1 6 9 8 1 0 23 24 1 0 9 39 1 0 39 14 1 0 12 11 1 0 12 14 1 0 6 7 1 0 23 32 1 0 24 28 1 0 28 29 1 0 29 30 1 0 30 32 1 0 55 56 1 0 24 25 1 1 53 54 1 0 30 31 1 0 12 19 1 0 12 13 1 1 14 15 1 0 17 18 1 1 15 16 1 0 25 26 2 0 16 17 1 0 25 27 1 0 42 43 1 0 3 2 1 0 2 1 1 0 19 17 1 0 17 37 1 0 5 3 1 0 22 21 2 0 7 42 1 0 21 20 1 0 20 19 1 0 3 4 2 0 39 40 1 6 44 51 1 0 51 49 1 0 49 47 1 0 47 46 1 0 46 45 1 0 45 44 1 0 47 48 1 0 49 50 1 0 51 52 1 0 10 9 1 0 32 34 1 6 39 41 1 0 32 33 1 0 7 8 1 0 44 43 1 0 7 61 1 6 55121 1 1 56122 1 0 53119 1 6 54120 1 0 42109 1 1 5 60 1 6 10 63 1 0 10 64 1 0 9 62 1 6 11 65 1 0 11 66 1 0 14 70 1 6 15 71 1 0 15 72 1 0 16 73 1 0 16 74 1 0 19 78 1 6 21 81 1 0 20 79 1 0 20 80 1 0 40103 1 0 40104 1 0 40105 1 0 41106 1 0 41107 1 0 41108 1 0 36 98 1 0 36 99 1 0 35 96 1 0 35 97 1 0 38100 1 0 38101 1 0 38102 1 0 23 82 1 1 28 84 1 0 28 85 1 0 29 86 1 0 29 87 1 0 30 88 1 1 31 89 1 0 31 90 1 0 31 91 1 0 13 67 1 0 13 68 1 0 13 69 1 0 18 75 1 0 18 76 1 0 18 77 1 0 27 83 1 0 1 57 1 0 1 58 1 0 1 59 1 0 44110 1 1 47113 1 1 48114 1 0 49115 1 1 50116 1 0 51117 1 6 52118 1 0 46111 1 0 46112 1 0 34 95 1 0 33 92 1 0 33 93 1 0 33 94 1 0 M END