RDKit 3D 138138 0 0 0 0 0 0 0 0999 V2000 12.0357 -1.4486 3.2771 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7826 -0.3206 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1116 -0.6755 1.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8498 -0.9279 0.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1748 -1.3031 -1.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9668 -1.5303 -1.8924 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0779 -0.3971 -2.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8019 -0.2939 -1.8154 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -1.3751 -1.2327 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2898 -0.8377 0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3077 -0.4673 1.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8447 0.0883 2.3398 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1488 1.3705 2.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8244 1.3625 1.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0163 0.3982 1.7788 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4334 2.5154 0.8473 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1199 2.5731 0.3031 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9620 1.7696 -0.9523 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9145 1.5276 -1.6937 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6577 1.2677 -1.2998 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4229 1.9791 -1.0155 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3578 1.5431 -2.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6769 0.6214 -2.8062 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8803 2.1295 -2.0314 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 1.8071 -2.8812 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5295 1.2985 -4.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7313 2.2920 -4.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9009 0.8596 -2.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5625 0.6167 -0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 0.2635 -2.7013 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8784 -0.6443 -1.9042 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5603 -2.0415 -2.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7723 -2.2711 -3.7353 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1831 -2.0539 -4.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1037 -2.9939 -3.5847 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -2.7893 -2.4239 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3694 -4.2367 -4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 -5.2631 -3.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 -4.4224 -5.3575 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8137 -0.2561 -0.4828 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8171 0.9452 -0.1387 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7436 -1.2776 0.5451 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -0.7665 1.9339 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6888 -1.5762 2.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0076 -2.9345 2.7039 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0458 -0.7889 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6913 -1.8867 2.3084 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5946 0.2528 3.2202 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8972 0.3055 3.8150 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.8580 0.3325 2.5872 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2348 0.4128 3.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3113 0.3298 2.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1411 1.3175 1.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6510 2.5668 1.2088 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4561 1.0662 -0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9162 -0.2644 -0.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2715 1.9779 -1.0313 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0715 1.4144 4.7259 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1295 2.2888 4.8812 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2032 1.6213 5.4757 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9083 1.5951 0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5517 2.7839 1.2291 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6305 3.5885 1.7158 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5706 4.3735 1.0574 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5265 5.6563 1.2762 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6481 3.9723 0.1292 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7536 4.7971 0.5269 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9769 -1.2127 4.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5749 -2.4375 3.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0055 -1.5787 2.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1692 0.5927 2.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7336 -0.1887 3.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7765 -1.5462 1.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6501 0.2131 0.7085 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2923 -1.7227 0.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2559 0.0321 0.3515 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -0.5774 -1.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7246 -2.2801 -0.9921 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3669 -1.8099 -2.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4284 -2.4717 -1.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5589 0.5221 -2.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3014 0.6840 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1509 -1.6347 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5282 -2.2780 -0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7096 -1.7397 0.4125 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5802 -0.0464 -0.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9969 -1.3496 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0373 0.2816 0.5716 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6691 0.0931 3.1037 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 -0.6513 2.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8311 2.0684 1.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 1.8723 3.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 3.2838 0.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4706 2.0808 1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 0.3424 -1.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4653 3.0485 -1.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1024 2.9430 -1.3549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6294 2.7401 -3.0644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 1.1192 -4.8798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9927 0.3565 -4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2957 3.0512 -5.1463 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3349 0.4350 -3.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9285 -0.3932 -2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1147 -2.8135 -1.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4773 -2.2662 -2.0802 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1023 -1.6252 -4.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -3.3633 -3.9117 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5101 -0.9905 -4.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2279 -2.1898 -5.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7101 -2.8696 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7308 -6.2213 -3.6381 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6753 -4.9229 -2.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1481 -5.3409 -4.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7372 -2.2460 0.2798 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3816 0.3054 1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6856 -1.1953 3.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6823 -1.3614 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1625 -3.4395 2.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0064 1.1309 3.3611 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1190 -0.6928 4.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5604 1.1950 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5789 -0.5725 2.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3647 1.3937 3.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4058 -0.3543 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4216 -0.7218 1.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3066 0.5892 2.5501 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1408 3.0707 1.8721 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9445 -0.9894 0.2805 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9092 -0.1447 -0.9751 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5395 -0.7401 -1.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6264 1.0083 6.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0853 1.0531 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5248 0.8374 0.8741 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1095 2.4635 2.0912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1286 3.4215 0.5978 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7331 3.5895 2.8099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4913 4.2803 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2561 5.0912 -0.2481 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 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 37 39 2 0 31 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 43 46 1 0 46 47 2 0 46 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 55 57 2 0 49 58 1 0 58 59 2 0 58 60 1 0 21 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 64 65 2 0 64 66 1 0 66 67 1 0 66 17 1 0 1 68 1 0 1 69 1 0 1 70 1 0 2 71 1 0 2 72 1 0 3 73 1 0 3 74 1 0 4 75 1 0 4 76 1 0 5 77 1 0 5 78 1 0 6 79 1 0 6 80 1 0 7 81 1 0 8 82 1 0 9 83 1 0 9 84 1 0 10 85 1 0 10 86 1 0 11 87 1 0 11 88 1 0 12 89 1 0 12 90 1 0 13 91 1 0 13 92 1 0 16 93 1 0 17 94 1 1 20 95 1 0 21 96 1 1 24 97 1 0 25 98 1 6 26 99 1 0 26100 1 0 27101 1 0 30102 1 0 31103 1 6 32104 1 0 32105 1 0 33106 1 0 33107 1 0 34108 1 0 34109 1 0 36110 1 0 38111 1 0 38112 1 0 38113 1 0 42114 1 0 43115 1 6 44116 1 0 44117 1 0 45118 1 0 48119 1 0 49120 1 1 50121 1 0 50122 1 0 51123 1 0 51124 1 0 52125 1 0 52126 1 0 54127 1 0 56128 1 0 56129 1 0 56130 1 0 60131 1 0 61132 1 0 61133 1 0 62134 1 0 62135 1 0 63136 1 0 66137 1 6 67138 1 0 M END