RDKit 3D 125127 0 0 0 0 0 0 0 0999 V2000 10.2575 -1.6622 -0.7102 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1544 -0.6119 -0.7048 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 0.3949 0.3797 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7140 1.1309 0.2117 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2566 1.3476 0.5328 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0650 0.5737 0.8655 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8688 0.6818 0.1065 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7809 1.4534 -0.8943 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7626 -0.1045 0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4745 -0.0454 -0.2080 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1490 -1.4579 -0.5972 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2911 -2.1964 0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0262 -2.7556 -0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8204 -4.2022 0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1201 -4.9850 -0.9186 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0857 -4.8003 -1.5837 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2828 -5.5449 -2.6306 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1999 -3.8710 -1.2822 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5280 -3.8332 0.1757 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9645 -5.1796 0.7075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7623 -6.4782 0.5449 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4211 -8.0126 1.2116 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0029 -2.5996 -1.9218 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8766 -1.5555 -2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0277 -1.1184 -3.3723 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7344 -0.8053 -1.1750 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1537 -1.2468 -1.2674 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0011 -0.5270 -0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4228 -1.0022 -0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2315 -0.3274 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5354 -0.7515 -1.5253 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0404 -1.8372 -0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2359 -2.5098 0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9456 -2.0741 0.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6261 0.6294 -1.4743 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 1.1480 -2.5373 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7548 1.5156 -0.8508 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2316 2.4375 -1.5912 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3239 1.5644 0.5598 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4818 1.6515 1.5201 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3781 2.8307 1.3793 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7601 4.1522 1.5769 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2881 4.9313 0.5589 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6961 6.1625 0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 6.6597 1.9952 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0217 5.9122 3.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6186 4.6655 2.8556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3368 2.5679 0.8432 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 3.0120 0.1002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2147 4.2759 -0.1509 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8936 2.2269 -0.4606 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0172 3.1982 -0.7465 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5753 4.2473 -1.7542 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3605 3.8699 0.5884 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 1.1762 0.4159 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5099 0.5868 0.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8461 0.6015 1.9451 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5261 2.3613 1.6024 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7708 2.4313 2.5958 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6168 3.2111 1.4686 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8331 -1.5322 0.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8169 -2.6710 -0.7091 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 -1.5440 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1553 -0.0559 -1.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 -1.0880 -0.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5029 -0.1864 1.3451 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 1.3534 1.2085 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4147 0.4702 -0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4893 2.0567 -0.3681 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0681 1.8861 -0.3952 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1394 -0.0495 1.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7871 -0.7636 1.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6324 0.6004 -1.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0727 -2.0401 -0.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5994 -1.3882 -1.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9812 -1.6662 1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8555 -3.1013 0.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1629 -2.1508 0.0143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2189 -2.7135 -1.4099 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4403 -4.3281 1.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8863 -4.5997 0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6208 -5.9079 -1.1746 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1352 -4.3845 -1.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -3.4637 0.8301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3912 -3.1588 0.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9276 -5.4583 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1742 -5.0561 1.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 -8.3223 0.5683 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7823 -7.8687 2.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6517 -8.8205 1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9991 -2.4311 -2.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -0.8939 -0.1523 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 -2.3473 -0.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6021 -1.2626 -2.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9193 0.5666 -0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6952 -0.8130 0.7898 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8364 0.5258 -1.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2045 -0.2429 -2.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0776 -2.1711 -0.9623 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5933 -3.3494 0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2842 -2.5910 0.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0151 0.4098 -3.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1866 1.8595 -2.0898 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8492 1.8048 -3.2272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8663 0.5298 0.7549 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0705 0.7380 1.4247 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0307 1.7349 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 2.8234 0.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2198 2.6605 2.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3845 4.5811 -0.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 6.7491 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0887 7.6434 2.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9039 6.3315 4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9521 4.1434 3.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4667 3.0563 1.7946 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5144 1.7512 -1.4008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9363 2.7787 -1.1164 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5614 5.2506 -1.2838 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3261 4.3469 -2.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6335 3.9771 -2.2743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 3.4140 1.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2109 4.9649 0.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4387 3.7318 0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4584 0.7601 0.9846 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2787 3.4081 2.1998 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 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 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 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 18 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 26 35 1 0 35 36 1 0 35 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 2 0 39 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 51 52 1 0 52 53 1 0 52 54 1 0 51 55 1 0 55 56 1 0 56 57 2 0 5 58 1 0 58 59 2 0 58 60 1 0 56 10 1 0 34 29 1 0 47 42 1 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 1 4 67 1 0 4 68 1 0 4 69 1 0 5 70 1 6 6 71 1 0 9 72 1 0 10 73 1 6 11 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 18 83 1 6 19 84 1 0 19 85 1 0 20 86 1 0 20 87 1 0 22 88 1 0 22 89 1 0 22 90 1 0 23 91 1 0 26 92 1 1 27 93 1 0 27 94 1 0 28 95 1 0 28 96 1 0 30 97 1 0 31 98 1 0 32 99 1 0 33100 1 0 34101 1 0 36102 1 0 36103 1 0 36104 1 0 39105 1 1 40106 1 0 40107 1 0 41108 1 0 41109 1 0 43110 1 0 44111 1 0 45112 1 0 46113 1 0 47114 1 0 48115 1 0 51116 1 6 52117 1 6 53118 1 0 53119 1 0 53120 1 0 54121 1 0 54122 1 0 54123 1 0 55124 1 0 60125 1 0 M END