HMDB0088960 RDKit 3D CL(i-12:0/i-22:0/i-14:0/i-22:0) 252251 0 0 0 0 0 0 0 0999 V2000 8.9267 1.8389 -4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5856 1.7833 -3.7696 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8118 1.8232 -2.2524 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 2.9700 -4.1976 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5617 2.9613 -5.6748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8188 1.7529 -6.1689 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4765 1.6447 -5.4941 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6574 0.4985 -6.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3443 0.3701 -5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -0.6636 -6.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1654 -0.7954 -5.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7854 -1.6463 -6.0124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4527 -3.0577 -6.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3192 -3.8181 -4.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0754 -5.2428 -5.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0313 -6.1643 -4.0824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1085 -5.9832 -3.1209 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -4.8524 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1038 -4.7097 -1.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4669 -3.5536 -0.2783 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3159 -3.2439 0.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7209 -2.8346 0.8478 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3906 -2.8358 -0.2238 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -2.4333 1.9492 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5855 -2.0048 2.3325 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5438 -0.5982 2.9559 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8468 -0.2463 3.4069 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9117 0.9912 4.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8159 1.6488 4.1854 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1145 1.5849 4.6677 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 2.8681 5.3356 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6438 4.1642 4.7572 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6686 4.4353 3.6847 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1781 3.9126 2.3126 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3292 4.7796 1.9152 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0052 4.4924 0.6484 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8229 3.2882 0.4804 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2829 1.9335 0.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1761 1.6071 -0.4272 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7443 0.1565 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -0.7711 -0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -0.1359 -1.3116 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1615 -2.8356 3.5206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3824 -4.0484 3.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8001 -5.4738 3.7156 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.3562 -6.5151 2.6635 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5221 -5.6099 3.8665 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2375 -6.1250 5.2145 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6353 -7.3383 5.0163 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1439 -7.9908 6.2784 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5393 -9.1929 5.9571 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2062 -7.1200 7.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0476 -6.8287 6.3892 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0637 -5.7905 7.2966 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.7143 -5.5658 8.6595 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4627 -6.4334 7.5911 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0039 -4.3066 6.5108 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2998 -3.7974 6.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2108 -2.4672 5.6186 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2624 -1.5459 6.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2838 -0.2825 5.6856 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0299 -0.0907 4.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2401 -1.0658 3.6558 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0694 1.2581 3.7087 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1033 1.1352 2.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 0.4131 1.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4347 0.2324 0.2599 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6815 -0.5646 -0.0808 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8377 -0.7461 -1.5711 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0206 -1.6043 -1.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3066 -1.0236 -1.4814 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4413 -1.9644 -1.9048 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4349 -2.0865 -3.4016 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2103 -3.3302 -1.2513 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4874 -1.8688 5.4457 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1106 -1.9255 4.1961 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4947 -2.6165 3.3086 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3701 -1.2621 3.8327 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6455 -1.9406 4.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8654 -1.2146 3.6479 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2084 0.0899 4.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3681 1.2726 4.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0743 1.7784 2.6915 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1697 2.9700 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8761 3.6730 1.5243 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9493 4.8356 1.7528 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 5.6754 0.5845 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 5.1239 -0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7271 4.5491 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2144 4.0741 -1.9024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 5.1907 -2.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6025 4.7462 -4.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8092 4.1406 -4.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0701 3.8460 -5.6838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3639 3.2844 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7818 1.9546 -5.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8962 1.8233 -4.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 1.6022 -6.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2369 2.8751 -4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8153 1.2967 -5.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6843 1.3016 -3.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1227 0.8208 -4.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8359 2.0836 -1.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1708 0.8563 -1.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5295 2.6252 -2.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7901 2.9628 -3.6871 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3054 3.9188 -3.9045 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0383 3.9094 -5.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5548 2.9562 -6.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3859 0.8151 -5.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7157 1.7442 -7.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5619 1.5491 -4.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 2.6166 -5.6657 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2741 -0.4101 -5.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4867 0.6355 -7.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4524 0.0376 -4.3108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7767 1.3336 -5.3749 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0149 -1.6324 -6.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2077 -0.3429 -7.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4267 -1.2109 -4.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2256 0.2009 -5.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0768 -1.0900 -6.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7444 -1.6542 -5.3585 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5815 -3.1273 -6.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1785 -3.5794 -6.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1678 -3.5884 -4.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5685 -3.3533 -4.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8491 -5.3186 -5.8896 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -5.6743 -5.9147 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1354 -7.2559 -4.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9929 -6.2509 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0874 -6.0425 -3.7217 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2078 -6.9315 -2.4738 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1719 -5.1018 -1.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5143 -3.8721 -2.6124 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8488 -4.5125 -1.6636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1182 -5.6430 -0.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.7426 0.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5057 -2.5969 -0.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2302 -2.4348 1.4885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2113 -4.1199 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4042 -1.9560 1.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8722 -0.6666 3.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2055 0.1646 2.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9741 1.6109 3.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4872 0.8387 5.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7389 3.0057 6.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0167 2.7032 6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6181 4.7474 4.5782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2541 4.8330 5.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6485 5.5823 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6298 4.2035 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5114 2.9204 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 3.9551 1.5922 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0842 4.7209 2.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9773 5.8614 1.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6108 5.4225 0.3384 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1751 4.5274 -0.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4408 3.4168 -0.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6727 3.3233 1.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1727 1.2377 0.3127 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9955 1.6080 1.5473 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5633 1.7349 -1.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2988 2.2339 -0.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3317 -0.0407 0.7386 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4461 -1.0371 0.4785 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5878 -1.7282 -0.9162 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6664 -0.3219 -1.1712 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8369 0.5193 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4524 -1.2163 -1.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1789 0.1212 -2.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1115 -2.2614 3.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4329 -2.6257 4.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -6.5455 3.7144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8614 -7.3236 4.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4356 -8.0257 4.6211 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0383 -8.2367 6.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6308 -9.4580 5.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6741 -6.1839 7.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9257 -7.6863 7.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8301 -6.9507 6.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -4.4843 5.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7266 -3.5698 7.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8365 -2.7976 4.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3703 -1.4931 7.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7747 -1.9794 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8836 1.8894 4.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8723 1.7565 4.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 2.1573 1.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8316 0.5919 1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4056 -0.5208 2.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1926 1.0910 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5606 -0.3511 -0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4503 1.1642 -0.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6006 -0.0167 0.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5595 -1.5641 0.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0291 0.2812 -2.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9082 -1.0907 -2.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9846 -1.8179 -3.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9237 -2.6089 -1.4569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3344 -0.8672 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5286 -0.0458 -1.9591 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4266 -1.5865 -1.6159 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -2.0516 -3.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9472 -3.0446 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8868 -1.2429 -3.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1873 -3.7439 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6452 -3.9772 -1.9575 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6436 -3.1656 -0.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -0.9456 2.7479 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3815 -0.2839 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8019 -2.2411 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6748 -2.9449 3.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -1.1071 2.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7433 -1.9039 3.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2694 0.3903 3.9148 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3484 -0.0843 5.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0828 2.1489 4.4704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5277 1.4398 4.7675 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5348 1.0411 2.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0182 2.0132 2.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2301 2.7049 3.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6836 3.7375 3.4776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8064 4.0047 1.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 2.9609 0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2944 5.4356 2.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9528 4.4389 2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7012 6.1343 0.2798 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1168 6.6066 0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7801 4.3394 -1.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1025 5.9237 -1.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0067 5.2648 -0.1212 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8303 3.6105 0.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2834 3.4972 -1.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9996 3.3700 -2.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4625 6.0240 -2.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1194 5.6648 -2.9892 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 5.6154 -4.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2625 3.9512 -4.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4963 4.9554 -3.8888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7701 3.2704 -3.5827 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9575 4.8597 -6.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2107 3.2064 -6.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1534 4.0461 -5.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4414 3.2942 -7.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1058 1.1403 -6.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0193 1.3477 -3.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8049 1.1878 -3.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0847 2.7955 -3.6931 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0563 1.4905 -7.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8773 2.4368 -6.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4859 0.6745 -5.7259 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 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 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 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 27 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 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 25 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 45 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 54 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 2 0 62 64 1 0 64 65 1 0 65 66 1 0 66 67 1 0 67 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 71 72 1 0 72 73 1 0 72 74 1 0 59 75 1 0 75 76 1 0 76 77 2 0 76 78 1 0 78 79 1 0 79 80 1 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 85 86 1 0 86 87 1 0 87 88 1 0 88 89 1 0 89 90 1 0 90 91 1 0 91 92 1 0 92 93 1 0 93 94 1 0 94 95 1 0 95 96 1 0 96 97 1 0 96 98 1 0 1 99 1 0 1100 1 0 1101 1 0 2102 1 0 3103 1 0 3104 1 0 3105 1 0 4106 1 0 4107 1 0 5108 1 0 5109 1 0 6110 1 0 6111 1 0 7112 1 0 7113 1 0 8114 1 0 8115 1 0 9116 1 0 9117 1 0 10118 1 0 10119 1 0 11120 1 0 11121 1 0 12122 1 0 12123 1 0 13124 1 0 13125 1 0 14126 1 0 14127 1 0 15128 1 0 15129 1 0 16130 1 0 16131 1 0 17132 1 0 17133 1 0 18134 1 0 18135 1 0 19136 1 0 19137 1 0 20138 1 0 20139 1 0 21140 1 0 21141 1 0 25142 1 6 26143 1 0 26144 1 0 30145 1 0 30146 1 0 31147 1 0 31148 1 0 32149 1 0 32150 1 0 33151 1 0 33152 1 0 34153 1 0 34154 1 0 35155 1 0 35156 1 0 36157 1 0 36158 1 0 37159 1 0 37160 1 0 38161 1 0 38162 1 0 39163 1 0 39164 1 0 40165 1 0 41166 1 0 41167 1 0 41168 1 0 42169 1 0 42170 1 0 42171 1 0 43172 1 0 43173 1 0 47174 1 0 49175 1 0 49176 1 0 50177 1 0 51178 1 0 52179 1 0 52180 1 0 56181 1 0 58182 1 0 58183 1 0 59184 1 6 60185 1 0 60186 1 0 64187 1 0 64188 1 0 65189 1 0 65190 1 0 66191 1 0 66192 1 0 67193 1 0 67194 1 0 68195 1 0 68196 1 0 69197 1 0 69198 1 0 70199 1 0 70200 1 0 71201 1 0 71202 1 0 72203 1 0 73204 1 0 73205 1 0 73206 1 0 74207 1 0 74208 1 0 74209 1 0 78210 1 0 78211 1 0 79212 1 0 79213 1 0 80214 1 0 80215 1 0 81216 1 0 81217 1 0 82218 1 0 82219 1 0 83220 1 0 83221 1 0 84222 1 0 84223 1 0 85224 1 0 85225 1 0 86226 1 0 86227 1 0 87228 1 0 87229 1 0 88230 1 0 88231 1 0 89232 1 0 89233 1 0 90234 1 0 90235 1 0 91236 1 0 91237 1 0 92238 1 0 92239 1 0 93240 1 0 93241 1 0 94242 1 0 94243 1 0 95244 1 0 95245 1 0 96246 1 0 97247 1 0 97248 1 0 97249 1 0 98250 1 0 98251 1 0 98252 1 0 M END