RDKit 3D 181181 0 0 0 0 0 0 0 0999 V2000 4.4295 -4.9865 5.6347 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5927 -5.3839 4.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3524 -6.1009 3.6683 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1568 -5.2242 3.7599 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9091 -5.9308 3.2038 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2251 -4.9296 3.3696 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5518 -5.3749 2.8395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5736 -4.2491 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7649 -4.0110 4.4854 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6571 -2.8229 4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9788 -1.5491 4.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7964 -0.3735 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2518 0.9570 4.2686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8747 1.2588 4.8365 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9382 0.3626 4.4008 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8966 1.1636 6.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5078 1.4740 6.8437 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0687 0.9388 8.0358 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2239 2.2164 6.1461 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 2.6999 6.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0784 3.2112 4.9524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3298 4.2180 4.3235 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1106 2.7656 4.4598 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 2.9945 3.2884 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7454 1.8154 3.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6584 1.8395 1.8594 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0047 1.9036 0.5375 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0615 1.8786 -0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8566 0.6697 -0.5446 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0676 3.5362 2.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4764 4.8118 1.6462 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0759 3.0577 1.6773 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0316 2.3197 1.3044 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2802 2.7614 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1412 3.0915 -1.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1854 3.1204 -2.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8931 3.2796 -3.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 2.2041 -4.5152 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0697 1.7095 -5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4868 0.5938 -6.0733 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3196 2.1401 -5.5612 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5194 3.1550 -6.6489 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9134 4.4474 -6.7438 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5637 4.5759 -7.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9823 6.0282 -7.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 6.7408 -5.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1268 1.0268 -5.9927 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 0.1029 -5.7664 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2826 -0.6003 -6.9855 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -0.5371 -4.6173 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6449 -2.0219 -4.7238 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5645 -2.4659 -5.8059 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9016 -3.9528 -5.7849 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7435 -4.8235 -5.9478 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -4.7513 -4.9229 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0201 -0.1010 -3.3707 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.3611 -2.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3524 0.6701 -1.3099 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9119 -1.6238 -1.7567 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7777 -2.0067 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2063 -2.2267 -0.8885 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0768 -2.5999 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4798 -2.7920 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4512 -3.1617 0.7083 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6243 -1.6280 -1.3176 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.6006 -0.9432 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2627 -2.6602 -0.3838 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3214 -0.3516 -1.0146 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7005 -0.6484 -1.5862 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -1.2202 -2.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0495 -1.4985 -3.4937 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0377 -2.0578 -4.8809 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4094 -1.1603 -5.8333 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3131 0.2218 0.2219 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2852 0.8118 1.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4677 0.2800 2.5138 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4332 -4.9836 6.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9773 -3.9673 5.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8105 -5.7534 6.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4362 -6.1172 4.0698 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8297 -4.5326 3.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5621 -6.3635 2.6045 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2394 -7.0541 4.2347 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 -4.8145 4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -4.3367 3.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6926 -6.8545 3.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0811 -6.1062 2.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -4.7807 4.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0709 -4.0158 2.8194 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5388 -5.6304 1.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -6.2885 3.3649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1498 -3.3641 2.4842 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5374 -4.4996 2.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8686 -3.9413 5.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -4.8997 4.8724 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6601 -2.9358 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7052 -2.7307 5.9044 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9482 -1.6752 3.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9241 -1.5487 4.6202 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7844 -0.4772 4.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0856 -0.3998 5.7403 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1774 0.9560 3.1501 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9475 1.7532 4.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6594 2.3257 4.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.3819 4.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5876 1.9451 6.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2594 0.1872 6.6609 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0598 1.5208 8.8822 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5685 3.5107 7.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1938 1.8778 6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8239 5.1154 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6051 3.8302 3.5725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0387 0.9095 2.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3311 1.6154 3.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3085 0.9125 1.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4396 2.6698 1.9783 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3804 2.7634 0.3418 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3926 0.9813 0.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6656 2.7708 -0.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5448 1.9581 -1.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4341 -0.0259 0.1146 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8566 0.8604 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8787 5.6170 1.8608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1951 2.4425 2.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3459 3.6756 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4163 1.9584 -0.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 2.4278 -1.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5683 4.1235 -1.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5638 3.9545 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3976 2.2128 -2.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 4.1978 -4.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9541 3.5772 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1172 0.4286 -7.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7421 2.5371 -4.6291 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2661 2.5913 -7.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6657 3.2057 -6.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3827 4.9854 -7.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2008 5.1759 -5.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7655 4.1471 -8.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2119 4.0321 -6.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0751 6.0632 -7.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4824 6.4849 -8.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2607 6.2904 -5.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8898 7.7590 -5.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6135 -0.0777 -7.7533 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5951 -0.1942 -4.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0901 -2.4112 -3.7887 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6567 -2.5333 -4.8439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5388 -1.9321 -5.7912 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0906 -2.3823 -6.8391 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6112 -4.1090 -6.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4999 -4.1784 -4.8469 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2798 -4.6273 -6.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0993 -5.8966 -6.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9415 -5.3857 -5.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2022 -4.9239 -3.9921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8928 1.5114 -1.3282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1571 -2.4011 -2.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7184 -1.2253 0.2328 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2727 -2.9150 -0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -3.1292 -1.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6661 -1.4212 -1.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8078 -3.6143 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0341 -1.9269 1.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8548 -1.8400 -0.7582 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4925 -3.5524 -1.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2255 -3.7443 0.3232 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7397 -2.4460 1.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4443 -3.4314 -1.0052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8354 0.3173 -1.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2313 -1.2722 -0.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2341 0.3362 -1.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0915 -0.5851 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1457 -2.2072 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -2.2126 -2.8685 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6012 -0.5242 -3.5533 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -3.0707 -4.9527 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0855 -2.1743 -5.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4032 -1.3754 -5.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9372 -1.1539 -6.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7259 -0.6336 2.7681 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 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 2 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 24 30 1 0 30 31 1 0 30 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 41 47 1 0 47 48 2 0 48 49 1 0 48 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 50 56 1 0 56 57 2 0 57 58 1 0 57 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 59 65 1 0 65 66 2 3 66 67 1 0 66 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 71 72 1 0 72 73 1 0 68 74 1 0 74 75 2 0 75 76 1 0 75 33 1 0 1 77 1 0 1 78 1 0 1 79 1 0 2 80 1 0 2 81 1 0 3 82 1 0 3 83 1 0 4 84 1 0 4 85 1 0 5 86 1 0 5 87 1 0 6 88 1 0 6 89 1 0 7 90 1 0 7 91 1 0 8 92 1 0 8 93 1 0 9 94 1 0 9 95 1 0 10 96 1 0 10 97 1 0 11 98 1 0 11 99 1 0 12100 1 0 12101 1 0 13102 1 0 13103 1 0 14104 1 1 15105 1 0 16106 1 0 16107 1 0 18108 1 0 20109 1 0 20110 1 0 22111 1 0 24112 1 1 25113 1 0 25114 1 0 26115 1 0 26116 1 0 27117 1 0 27118 1 0 28119 1 0 28120 1 0 29121 1 0 29122 1 0 31123 1 0 33124 1 1 34125 1 0 34126 1 0 35127 1 0 35128 1 0 36129 1 0 36130 1 0 37131 1 0 37132 1 0 40133 1 0 41134 1 1 42135 1 0 42136 1 0 43137 1 0 43138 1 0 44139 1 0 44140 1 0 45141 1 0 45142 1 0 46143 1 0 46144 1 0 49145 1 0 50146 1 1 51147 1 0 51148 1 0 52149 1 0 52150 1 0 53151 1 0 53152 1 0 54153 1 0 54154 1 0 55155 1 0 55156 1 0 58157 1 0 59158 1 6 60159 1 0 60160 1 0 61161 1 0 61162 1 0 62163 1 0 62164 1 0 63165 1 0 63166 1 0 64167 1 0 64168 1 0 67169 1 0 68170 1 6 69171 1 0 69172 1 0 70173 1 0 70174 1 0 71175 1 0 71176 1 0 72177 1 0 72178 1 0 73179 1 0 73180 1 0 76181 1 0 M END