RDKit 3D 126125 0 0 0 0 0 0 0 0999 V2000 14.7228 3.2440 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2930 1.8398 0.4814 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1208 1.6045 1.9225 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1971 2.4142 2.7226 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7543 2.4534 2.4384 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3522 3.0129 1.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8207 3.0356 0.9897 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 1.6382 1.0991 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7225 0.7062 0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1384 -0.6640 0.2756 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6339 -0.5571 0.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9462 -1.8969 0.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4642 -1.6518 0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0244 -1.1471 -0.8658 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5488 -0.8419 -0.8566 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -0.9213 0.2259 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9354 -0.4933 -2.0152 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6053 -0.1751 -2.1253 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7401 -1.3823 -1.6639 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0143 -2.4826 -2.6081 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1411 -3.5502 -2.4123 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4774 -4.7603 -3.5508 P 0 0 2 0 0 5 0 0 0 0 0 0 1.3236 -4.1250 -4.6483 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0096 -5.2555 -4.2086 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2904 -6.0410 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7579 -6.5021 -1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -7.6779 -1.2090 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5594 -8.7129 -2.2371 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0722 -8.1692 0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7222 -9.3849 0.2233 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9292 -7.3453 1.1463 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 -0.8275 -1.7932 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2272 -0.4469 -0.6303 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5907 -0.6215 0.4649 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5963 0.1621 -0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 0.8290 0.7929 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0447 1.5230 0.9756 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2399 0.6961 0.9303 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1982 0.7945 0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1646 1.8033 -1.0338 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2945 0.9960 -2.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2664 1.1791 -3.1111 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3304 2.1694 -2.9507 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6340 1.4816 -2.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3987 1.6405 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0877 2.4924 -0.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1663 3.5198 -0.5625 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9710 3.7524 0.4213 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9207 2.9943 1.6777 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2231 2.2655 1.9971 C 0 0 2 0 0 0 0 0 0 0 0 0 -14.2790 3.1834 2.0989 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1168 1.5321 3.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3741 0.8042 3.6698 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5259 1.7782 3.7967 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8871 3.9644 0.1116 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5652 3.5260 0.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1115 3.1957 -0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5711 1.4683 -0.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2449 1.2206 0.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1570 1.5696 2.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8177 0.5041 2.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5865 3.4717 2.8928 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2806 2.0024 3.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3627 1.4074 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2492 3.0413 3.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7022 2.5204 0.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6335 4.1043 1.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4171 3.6239 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5827 3.5414 0.0554 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1341 1.7923 0.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4066 1.2735 2.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8211 0.6831 -0.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 1.0382 -0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4429 -1.0867 1.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5234 -1.3407 -0.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -0.0637 -0.6846 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3550 0.0384 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2213 -2.2202 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2619 -2.6186 -0.3046 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9437 -2.6165 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1849 -0.9250 1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -1.9641 -1.6201 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4948 -0.2241 -1.2172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3938 0.6664 -1.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3531 0.0707 -3.1659 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9953 -1.5511 -0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0102 -2.1653 -3.6789 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0433 -2.9209 -2.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6176 -4.4486 -4.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2957 -6.8214 -1.7571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8696 -5.7303 -0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6474 -7.3163 -1.0989 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5584 -8.9487 -2.4213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0449 -8.3460 -3.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0395 -7.2782 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3066 -0.6916 -0.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8242 0.8242 -1.4015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 0.0736 1.5694 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8994 1.5751 0.8292 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 1.9925 2.0385 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0463 2.4371 0.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3229 -0.0838 1.7155 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0767 0.1112 0.1296 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8507 2.6159 -0.9034 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1447 2.2776 -1.1399 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5296 0.2519 -2.4546 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3211 0.5492 -4.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2216 2.9273 -2.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3322 2.7555 -3.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9188 0.8352 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3660 1.0930 -1.7716 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0257 1.8704 0.3039 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1486 3.0444 -0.6582 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2618 4.1304 -1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7228 4.5534 0.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8788 3.7944 2.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0454 2.3883 1.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4474 1.5829 1.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3703 3.5772 1.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9149 2.3104 4.1035 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2267 0.8655 3.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5774 -0.0097 2.9745 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2037 0.3271 4.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2211 2.7709 4.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0369 1.8215 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2489 1.3797 4.5599 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 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 22 21 1 1 22 23 2 0 22 24 1 0 22 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 1 0 29 30 2 0 29 31 1 0 19 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 47 48 2 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 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 6 67 1 0 7 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 9 73 1 0 10 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 18 84 1 0 18 85 1 0 19 86 1 1 20 87 1 0 20 88 1 0 24 89 1 0 26 90 1 0 26 91 1 0 27 92 1 1 28 93 1 0 28 94 1 0 31 95 1 0 35 96 1 0 35 97 1 0 36 98 1 0 36 99 1 0 37100 1 0 37101 1 0 38102 1 0 39103 1 0 40104 1 0 40105 1 0 41106 1 0 42107 1 0 43108 1 0 43109 1 0 44110 1 0 45111 1 0 46112 1 0 46113 1 0 47114 1 0 48115 1 0 49116 1 0 49117 1 0 50118 1 6 51119 1 0 52120 1 0 52121 1 0 53122 1 0 53123 1 0 54124 1 0 54125 1 0 54126 1 0 M END