RDKit 3D 179188 0 0 0 0 0 0 0 0999 V2000 14.7031 -2.3806 1.9076 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0016 -0.9622 1.5046 C 0 0 2 0 0 0 0 0 0 0 0 0 13.9104 -0.1340 1.5272 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9486 -0.4574 0.5733 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0309 0.6052 0.5542 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7842 0.2587 1.0109 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5420 1.0858 2.2794 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4903 0.8129 3.2445 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 0.6748 2.8042 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1978 0.9357 1.8522 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3734 0.1678 0.6993 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3295 0.4649 -0.1416 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5926 -0.6515 -0.5344 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2384 -0.5124 0.1105 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3331 -0.9274 1.5711 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2673 -1.2755 -0.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0695 -0.7409 -1.7829 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0055 0.6215 -1.6237 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7672 1.1798 -1.9624 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2613 2.0095 -0.8110 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9623 1.6419 -0.3777 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7329 1.1834 0.9165 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6896 1.0956 1.6914 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6538 0.7958 1.3936 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4529 0.1165 2.7035 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -1.1603 2.5462 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3093 -2.0117 1.4819 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7493 -3.0905 1.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5146 -2.7176 1.9912 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4936 -1.2900 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2389 -0.0024 0.2931 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6943 -0.0696 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3533 -0.9588 -0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -1.1188 -0.6664 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5446 -0.0665 0.0730 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0337 -0.0112 -0.1752 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4542 -0.0422 -1.5984 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5953 -1.2796 0.4731 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6813 -1.0381 1.4560 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.3683 -2.2656 1.6185 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7184 -0.0550 0.9571 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3551 -0.5150 -0.1779 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6986 -0.8014 0.0506 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.9000 -2.1770 -0.0599 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4210 -2.5847 -1.2611 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.8924 -3.9575 -1.5399 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2130 -4.5719 -2.5881 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0313 -4.6118 -0.6639 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0445 -1.7196 -2.4285 C 0 0 1 0 0 0 0 0 0 0 0 0 -12.6816 -2.2710 -3.5594 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6294 -0.3356 -2.2397 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.9428 0.6243 -2.9777 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6493 -0.0040 -0.7852 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.9331 -0.2602 -0.2915 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0151 1.2644 0.7938 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.7424 2.0648 -0.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2565 1.9916 2.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6487 2.1346 2.3158 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5528 1.1606 0.6199 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9366 2.4650 0.1984 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9122 2.7224 -1.1393 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4661 2.4007 0.6463 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7965 1.2117 0.0568 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2519 1.6141 -1.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5215 0.9601 0.9132 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8994 0.6202 2.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 2.2229 0.9028 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3667 2.1262 1.5388 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3488 2.4268 2.9104 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2175 3.3683 -1.1463 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3273 3.5826 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9273 3.0315 -3.4568 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4446 4.1389 -4.1591 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0814 2.1451 -3.1143 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2035 2.8695 -2.7223 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2591 -1.1873 -2.5948 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2084 -2.5826 -2.6762 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5654 -0.7260 -2.0107 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8814 0.5078 -2.6113 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6647 0.6320 0.0627 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8846 0.0635 -1.1686 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4915 -0.6289 -0.8019 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5682 -1.4284 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8057 -1.3284 -0.8993 C 0 0 2 0 0 0 0 0 0 0 0 0 14.6629 -2.7159 -0.9106 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7268 -0.8804 0.1856 C 0 0 1 0 0 0 0 0 0 0 0 0 16.0593 0.4533 -0.0451 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9331 -2.8694 1.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6347 -2.9749 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3134 -2.3809 2.9554 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7205 -0.5643 2.2731 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3848 -1.3319 0.9648 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6890 -0.8041 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4858 2.1572 1.9982 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1421 1.5425 3.3557 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2323 -0.3987 3.0352 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9412 1.2954 3.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4801 -0.9054 0.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0755 -1.5423 -0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9567 0.5687 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4861 -1.5861 1.8734 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4351 -0.0480 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2499 -1.5416 1.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -1.2215 -2.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0974 0.3846 -2.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9512 1.8733 0.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3479 0.0029 3.3372 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2174 0.7970 3.3029 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -1.7324 3.5188 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3753 -1.0208 2.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.5705 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8752 -3.7782 2.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6971 -2.5158 1.0285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0487 -2.1713 2.7949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1836 -3.6908 2.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -3.0196 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5639 -1.0103 -0.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8222 -1.9909 -0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9259 0.5751 -0.6544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7546 -1.6969 -1.0319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9891 -1.1391 -1.7637 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1212 -2.1186 -0.2747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4889 -0.4245 1.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0006 0.8535 -1.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1944 -0.8802 -1.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6732 -0.2255 -2.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8096 -1.8800 0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0084 -1.9881 -0.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3393 -0.7580 2.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7226 -2.9444 1.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4993 -0.0353 1.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9456 -0.5736 1.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5350 -2.6857 -1.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0111 -5.5930 -0.4982 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9705 -1.7116 -2.6189 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3676 -1.8618 -4.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6748 -0.3168 -2.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3352 1.4978 -2.7275 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4528 1.0738 -0.5641 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9156 -0.5493 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6600 2.4734 0.2464 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1824 2.9389 -0.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1410 1.4286 -1.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8579 3.0179 2.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7783 1.4524 2.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8814 3.0290 2.6334 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1293 0.9877 1.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3882 3.2741 0.7628 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 3.6940 -1.2712 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0283 3.3361 0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4892 2.4788 1.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2191 1.2465 -1.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8533 1.2593 -2.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2847 2.7420 -1.3929 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6572 -0.4173 2.6054 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9424 0.7779 2.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3263 1.2712 3.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5651 2.6115 -0.1447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2385 3.0486 1.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7604 2.9758 1.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2196 3.3726 3.0979 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1393 4.6753 -2.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3436 3.1141 -1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1647 2.5199 -4.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4376 4.1576 -4.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3435 1.5275 -4.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 2.3195 -2.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1321 -0.8093 -3.6305 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4117 -2.9657 -1.7746 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3527 -1.4373 -2.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4661 0.3870 -3.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5762 1.7414 -0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5967 -0.8604 -1.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5068 0.3621 -1.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7905 -1.2810 -2.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2699 -1.0408 -1.8689 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3314 -3.1637 -1.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6612 -1.4739 0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8812 0.7147 0.4756 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 7 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 18 19 1 0 19 74 1 0 74 75 1 0 74 72 1 0 72 73 1 0 72 71 1 0 71 70 1 0 70 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 24 22 1 6 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 6 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 6 36 38 1 0 38 39 1 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 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 45 46 1 0 46 48 1 0 46 47 2 0 41 55 1 0 55 56 1 6 55 57 1 0 57 58 1 0 55 59 1 0 59 60 1 0 60 61 1 0 60 62 1 0 62 63 1 0 63 64 1 6 63 65 1 0 65 66 1 1 65 67 1 0 67 68 1 0 68 69 1 0 17 76 1 0 76 77 1 0 76 78 1 0 78 79 1 0 11 80 1 0 80 81 1 0 4 82 1 0 82 83 1 0 82 84 1 0 84 85 1 0 84 86 1 0 86 87 1 0 86 2 1 0 80 6 1 0 78 13 1 0 20 19 1 0 31 24 1 0 65 32 1 0 68 24 1 0 63 35 1 0 59 36 1 0 53 43 1 0 1 88 1 0 1 89 1 0 1 90 1 0 2 91 1 1 4 92 1 1 6 93 1 1 7 94 1 6 8 95 1 0 9 96 1 0 9 97 1 0 11 98 1 1 13 99 1 1 14100 1 1 15101 1 0 15102 1 0 15103 1 0 17104 1 6 19105 1 6 74166 1 6 75167 1 0 72164 1 6 73165 1 0 71162 1 0 71163 1 0 20106 1 1 25107 1 0 25108 1 0 26109 1 0 26110 1 0 28111 1 0 28112 1 0 28113 1 0 29114 1 0 29115 1 0 29116 1 0 30117 1 0 30118 1 0 31119 1 6 33120 1 0 34121 1 0 34122 1 0 35123 1 1 37124 1 0 37125 1 0 37126 1 0 38127 1 0 38128 1 0 39129 1 1 40130 1 0 41131 1 1 43132 1 1 45133 1 1 49135 1 6 50136 1 0 51137 1 6 52138 1 0 53139 1 6 54140 1 0 48134 1 0 56141 1 0 56142 1 0 56143 1 0 57144 1 0 57145 1 0 58146 1 0 59147 1 1 60148 1 1 61149 1 0 62150 1 0 62151 1 0 64152 1 0 64153 1 0 64154 1 0 66155 1 0 66156 1 0 66157 1 0 67158 1 0 67159 1 0 68160 1 6 69161 1 0 76168 1 6 77169 1 0 78170 1 6 79171 1 0 80172 1 6 81173 1 0 82174 1 6 83175 1 0 84176 1 6 85177 1 0 86178 1 1 87179 1 0 M END