RDKit 3D 115121 0 0 0 0 0 0 0 0999 V2000 -3.7685 -1.3719 3.3977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 -0.0183 3.2402 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2425 0.3337 1.9196 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3462 1.4585 1.4564 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2935 0.9373 0.7694 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0302 1.1649 1.3683 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4035 -0.1140 1.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9658 -0.3794 1.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 0.8745 1.2271 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6327 1.5074 2.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1329 1.8341 0.2180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3743 1.3158 -1.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7858 0.9888 -1.4805 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5264 0.2341 -0.4299 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2058 0.7663 0.9129 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9950 -0.0460 1.9144 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 0.3824 1.7577 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9142 0.5513 0.3772 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3809 1.9902 0.1809 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -0.3808 0.2016 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3985 0.2804 0.4962 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4226 0.4233 -0.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4733 1.1348 0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6057 1.4523 -0.1036 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0635 1.4383 1.6538 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7517 0.9064 1.7933 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9924 -0.9604 -1.1641 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5680 -2.2420 -1.2436 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4096 -2.6234 -2.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0137 -3.9630 -2.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6256 -1.7274 -3.1706 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 -1.1654 -1.2177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9921 0.1904 -0.7304 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2295 1.0649 -1.8029 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3092 2.0675 0.4278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 2.4396 0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7736 1.9675 -0.3007 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6357 3.0979 -0.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5312 3.5832 0.1404 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6760 0.8154 0.0545 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1526 -0.3762 -0.4464 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0342 -1.0979 -1.2070 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2698 -2.3019 -0.5313 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3344 -2.9933 -1.1123 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.6567 -2.5690 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6996 -3.2687 -1.0802 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3786 -2.8492 -2.6017 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.2317 -1.7980 -2.9509 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -2.6455 -3.1345 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0814 -2.5103 -4.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4196 -1.3609 -2.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7419 -0.2541 -3.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6786 0.7197 1.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9964 1.9490 2.0975 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1098 1.9685 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -1.6106 2.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5669 -2.0467 3.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5546 -1.5363 4.4842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0656 -0.6036 1.3086 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9624 1.9588 2.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2856 1.7165 2.3018 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3159 -0.3046 2.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 -0.9804 1.3602 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8281 -0.7191 0.0977 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3887 -1.2423 1.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6188 1.8786 2.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3046 0.7820 3.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 2.4033 2.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7424 2.7605 0.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6532 0.5188 -1.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0918 2.1952 -1.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3734 1.8694 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7817 0.3146 -2.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1618 -0.8360 -0.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6356 1.8067 0.9732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8274 -1.1291 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6938 0.1566 2.9647 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -0.3311 2.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5306 1.3456 2.3409 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4215 2.0608 -0.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1543 2.6288 1.0658 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7702 2.4682 -0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 -1.2415 0.9281 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5224 0.0850 -1.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7265 0.1266 2.6004 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1085 1.7372 2.0942 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2824 -0.2970 -1.9944 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0138 -4.0217 -1.9037 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3515 -4.7541 -1.9552 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 -4.1911 -3.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1679 -1.3613 -2.2541 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -1.9930 -0.5481 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8748 0.6291 -2.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8025 2.1079 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4313 3.1259 0.7949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 1.6486 -1.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0008 3.9982 -1.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1825 2.8653 -1.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 3.1524 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7099 0.9046 -0.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0429 -0.6295 -1.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1947 -4.0652 -0.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6774 -2.8415 0.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8339 -1.4889 -0.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5677 -2.8089 -0.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7823 -3.7928 -3.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9602 -2.1212 -3.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3533 -3.4824 -2.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -2.3341 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3159 -1.4582 -2.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9104 0.0762 -3.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3419 -0.1112 1.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2351 3.0434 3.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0543 1.7401 2.3271 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0331 1.4071 3.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 1 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 6 18 20 1 0 20 27 1 0 27 32 1 0 32 33 1 0 33 34 1 6 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 11 35 1 0 4 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 37 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 44 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 40 53 1 0 53 54 1 0 54 55 1 0 53 3 1 0 35 6 1 0 51 42 1 0 15 9 1 0 33 18 1 0 26 21 1 0 33 14 1 0 1 56 1 0 1 57 1 0 1 58 1 0 3 59 1 6 4 60 1 1 6 61 1 1 7 62 1 0 7 63 1 0 8 64 1 0 8 65 1 0 10 66 1 0 10 67 1 0 10 68 1 0 11 69 1 6 12 70 1 0 12 71 1 0 13 72 1 0 13 73 1 0 14 74 1 1 15 75 1 6 16 76 1 0 16 77 1 0 17 78 1 0 17 79 1 0 19 80 1 0 19 81 1 0 19 82 1 0 20 83 1 1 27 87 1 6 32 91 1 0 32 92 1 0 34 93 1 0 30 88 1 0 30 89 1 0 30 90 1 0 22 84 1 0 26 85 1 0 26 86 1 0 35 94 1 0 35 95 1 0 37 96 1 6 38 97 1 0 38 98 1 0 39 99 1 0 40100 1 6 42101 1 6 44102 1 6 45103 1 0 45104 1 0 46105 1 0 47106 1 6 48107 1 0 49108 1 6 50109 1 0 51110 1 1 52111 1 0 53112 1 6 55113 1 0 55114 1 0 55115 1 0 M END