RDKit 3D 178180 0 0 0 0 0 0 0 0999 V2000 -4.2667 3.0275 -2.8014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 4.0871 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9762 5.0355 -1.4692 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0410 6.1502 -0.9974 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7842 4.4607 -0.3868 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4227 5.6747 0.2395 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8041 5.8356 0.2884 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 7.0137 0.2318 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 4.7307 0.4045 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.6010 5.0542 1.6902 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.6357 4.0000 2.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6986 5.0900 2.7743 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6992 4.7250 -0.7354 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1862 3.6581 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8071 3.6102 -2.7266 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0882 2.5385 -1.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3666 1.3623 -0.7087 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6576 0.0049 -0.8891 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8036 -0.6540 -1.6217 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7632 -0.8234 -0.3963 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.0968 -0.1425 -0.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6908 0.3478 -1.4981 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2157 0.1281 -2.6163 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8600 1.1010 -1.3956 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4309 -1.4644 0.8858 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1228 -2.8180 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7574 -3.4507 2.0017 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1332 -3.6241 0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9329 -3.7079 1.1148 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1687 -4.8551 1.3963 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9252 -5.2059 2.6024 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5829 -5.7432 0.3599 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3205 -7.1076 0.9201 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7445 -8.0445 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6215 -7.6556 -1.2669 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3561 -9.3223 0.3268 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4207 -5.1234 -0.2586 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0745 -5.3243 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3059 -5.6693 -0.9204 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3925 -5.1902 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6177 -3.9872 1.4838 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -3.7540 1.7817 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0225 -3.1176 2.8887 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0655 -4.1301 1.0145 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0287 -5.6089 0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0608 -5.8663 -0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3525 -5.5301 -1.5389 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1224 -4.1350 -1.5251 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0253 -3.4170 -0.2461 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.0186 -0.3202 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5411 -1.4286 -1.2112 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1061 -1.0985 0.3952 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3083 -0.9427 -0.3169 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.7353 -0.9895 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8008 0.4591 -1.4899 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5446 -1.7109 -1.3856 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5498 -2.9264 -0.4843 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8506 -2.5512 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0847 -2.5250 1.2105 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9172 -2.2507 1.8854 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7334 -0.9211 -1.1785 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7412 -0.6232 -2.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8144 -1.0459 -3.2541 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8078 0.2869 -1.5967 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8333 0.7114 -2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7937 1.6544 -1.5674 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3742 1.9667 -0.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0567 2.9841 0.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4217 3.1395 1.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5959 3.3229 0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1491 2.3713 -0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4945 1.0152 -0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1229 0.1004 -1.1874 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4161 0.4436 -1.8083 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6122 0.5660 -0.9318 C 0 0 2 0 0 0 0 0 0 0 0 0 16.8908 -0.7321 -0.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7228 1.6891 0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3731 0.1937 0.7712 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3224 0.8217 -0.3043 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5335 1.5590 -0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4695 1.1094 -0.9988 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8579 2.7402 0.5490 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2075 2.7520 1.9324 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0978 1.9239 2.7838 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2346 1.5604 1.8136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2358 2.7985 0.9650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 3.7230 0.7198 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8963 3.9962 1.8527 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6489 2.4156 -1.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0927 3.5969 -3.2978 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7884 2.4181 -3.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0598 4.6415 -3.3568 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 3.7254 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7107 5.5855 -2.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 6.3552 -1.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5343 7.0956 -0.7831 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4364 5.7770 -0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 3.9172 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7603 6.3665 0.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2765 3.8092 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0679 6.0480 1.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6330 4.2711 1.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7186 3.9225 3.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3277 2.9924 1.6552 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8722 5.8922 3.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0080 5.7066 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7935 2.3546 -1.9894 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8132 2.8404 -0.3008 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4502 1.5910 -0.1962 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9650 -1.6542 -1.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1008 0.6158 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7894 -0.9449 0.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7839 0.7768 -1.6462 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4368 -0.8093 1.7271 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9527 -3.2387 -0.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6053 -4.6321 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6100 -2.8024 1.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3985 -5.8861 -0.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3019 -7.5161 1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -7.1245 1.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1275 -10.0143 0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6569 -4.4393 -1.0462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8937 -6.1170 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2318 -5.0703 2.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2183 -3.0973 1.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8517 -3.8531 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -6.0800 1.8169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -6.0030 0.3956 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9243 -5.1921 -0.0677 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3182 -6.9432 -0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4877 -6.2411 -1.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0827 -5.7140 -2.3448 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2286 -4.1515 -1.7625 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3123 -3.5984 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4211 -1.4677 1.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9373 0.3557 -0.5304 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4861 -2.0171 -2.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -3.6665 -0.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5202 -3.4176 -0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0775 -2.4395 2.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8835 -0.5226 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6560 0.5778 -0.5557 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9651 0.3884 -3.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0164 2.5400 -2.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7166 0.9843 -1.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2583 0.9849 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2826 2.3137 -0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6984 4.0153 0.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4355 3.1369 1.6109 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4124 4.1035 1.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6815 2.4012 1.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4899 3.6840 0.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4188 4.3394 -0.3889 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5454 2.2697 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1548 2.7533 -1.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5839 0.4854 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1255 1.1694 0.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1832 -0.9141 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3569 -0.0820 -2.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3646 1.3442 -2.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6557 -0.3932 -2.5358 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5429 0.6429 -1.6156 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1951 -0.8386 0.6844 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9130 -0.5865 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9605 -1.6105 -0.8287 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8445 1.8870 0.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3878 1.4700 1.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3379 2.6377 -0.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2056 0.9103 1.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1966 -0.0006 1.6765 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1528 0.7172 -1.2649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 3.6301 0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 3.8213 2.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 2.5544 1.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5703 2.5374 3.6143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6632 1.0511 3.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0382 0.6736 1.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1281 1.4434 2.4016 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 10 12 1 0 9 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 20 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 32 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 2 0 42 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 2 0 50 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 56 57 1 0 57 58 1 0 58 59 2 0 58 60 1 0 56 61 1 0 61 62 1 0 62 63 2 0 62 64 1 0 64 65 2 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 73 74 1 0 74 75 1 0 75 76 1 0 75 77 1 0 52 78 1 0 78 79 1 0 79 80 1 0 80 81 2 0 80 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 2 0 87 5 1 0 49 44 1 0 86 82 1 0 1 89 1 0 1 90 1 0 1 91 1 0 2 92 1 0 2 93 1 0 3 94 1 6 4 95 1 0 4 96 1 0 4 97 1 0 5 98 1 6 6 99 1 0 9100 1 1 10101 1 6 11102 1 0 11103 1 0 11104 1 0 12105 1 0 13106 1 0 16107 1 0 16108 1 0 17109 1 0 20110 1 6 21111 1 0 21112 1 0 24113 1 0 25114 1 0 28115 1 0 28116 1 0 29117 1 0 32118 1 6 33119 1 0 33120 1 0 36121 1 0 37122 1 0 40123 1 0 40124 1 0 41125 1 0 44126 1 1 45127 1 0 45128 1 0 46129 1 0 46130 1 0 47131 1 0 47132 1 0 48133 1 0 48134 1 0 52135 1 1 53136 1 0 56137 1 6 57138 1 0 57139 1 0 60140 1 0 61141 1 0 64142 1 0 65143 1 0 66144 1 0 66145 1 0 67146 1 0 67147 1 0 68148 1 0 68149 1 0 69150 1 0 69151 1 0 70152 1 0 70153 1 0 71154 1 0 71155 1 0 72156 1 0 72157 1 0 73158 1 0 73159 1 0 74160 1 0 74161 1 0 75162 1 6 76163 1 0 76164 1 0 76165 1 0 77166 1 0 77167 1 0 77168 1 0 78169 1 0 78170 1 0 79171 1 0 82172 1 6 83173 1 0 83174 1 0 84175 1 0 84176 1 0 85177 1 0 85178 1 0 M END