0 mol 54 unq 0 iso 0 dist 5.0478 6.43082 6.14538 8.69776 5.27979 7.15034 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 5.39827 11.1921 9.25641 11.5007 9.83914 9.57611 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 9.51367 8.71534 7.02927 8.98705 5.54226 4.56372 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 5.80081 7.59723 8.10291 5.22187 4.92382 8.76709 numMergedOcc 0
4 mol 141 unq 1 iso 0 dist 6.35397 5.64577 9.97343 5.69432 9.38036 6.45283 numMergedOcc 0
5 mol 141 unq 2 iso 0 dist 6.35397 12.3864 9.70413 5.69432 9.38036 11.3136 numMergedOcc 0
6 mol 188 unq 0 iso 0 dist 6.1338 6.33907 8.10214 5.20357 8.4784 8.02684 numMergedOcc 0
7 mol 188 unq 1 iso 0 dist 7.47937 6.5153 7.14503 7.90572 8.34477 8.02684 numMergedOcc 0
8 mol 196 unq 0 iso 0 dist 6.67699 7.69186 6.70531 10.7769 6.14222 5.93821 numMergedOcc 0
9 mol 196 unq 1 iso 0 dist 6.67699 7.08535 6.86319 10.7769 6.14222 12.4987 numMergedOcc 0
10 mol 249 unq 0 iso 0 dist 9.68308 5.09262 5.48118 11.6107 8.76518 10.3504 numMergedOcc 0
11 mol 249 unq 1 iso 0 dist 9.68308 4.85486 7.25858 11.6107 8.76518 10.9925 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 9.58671 11.4295 8.00673 5.85558 8.1769 13.7796 numMergedOcc 0
13 mol 278 unq 1 iso 0 dist 9.58671 11.4295 8.00673 4.62289 7.1656 10.2359 numMergedOcc 0
14 mol 278 unq 2 iso 0 dist 9.58671 9.50272 6.62841 5.85558 8.1769 9.26354 numMergedOcc 0
15 mol 278 unq 3 iso 0 dist 9.58671 9.50272 6.62841 4.62289 7.1656 5.33325 numMergedOcc 0
16 mol 278 unq 4 iso 0 dist 8.60481 13.5463 8.00673 6.59605 8.1769 13.7796 numMergedOcc 0
17 mol 278 unq 5 iso 0 dist 8.60481 13.5463 8.00673 5.55931 7.1656 10.2359 numMergedOcc 0
18 mol 278 unq 6 iso 0 dist 8.60481 5.81569 6.62841 6.59605 8.1769 9.26354 numMergedOcc 0
19 mol 278 unq 7 iso 0 dist 8.60481 5.81569 6.62841 5.55931 7.1656 5.33325 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 5.61727 10.5879 6.78191 3.39008 7.74874 12.4957 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 5.62568 10.7971 6.89451 10.0544 7.99204 4.21609 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 8.82948 6.27066 6.89451 6.23875 7.99204 4.21609 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 9.52718 12.9284 8.91712 6.1158 9.25759 13.2948 numMergedOcc 0
24 mol 287 unq 3 iso 0 dist 9.52718 6.56751 9.65934 6.1158 9.25759 3.65199 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 5.62568 10.7971 6.89451 10.0544 7.99204 4.21609 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 8.82948 6.27066 6.89451 6.23875 7.99204 4.21609 numMergedOcc 0
27 mol 288 unq 2 iso 0 dist 9.52718 12.9284 8.91712 6.1158 9.25759 13.2948 numMergedOcc 0
28 mol 288 unq 3 iso 0 dist 9.52718 6.56751 9.65934 6.1158 9.25759 3.65199 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 5.62568 10.7971 6.89451 10.0544 7.99204 4.21609 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 8.82948 6.27066 6.89451 6.23875 7.99204 4.21609 numMergedOcc 0
31 mol 289 unq 2 iso 0 dist 9.52718 12.9284 8.91712 6.1158 9.25759 13.2948 numMergedOcc 0
32 mol 289 unq 3 iso 0 dist 9.52718 6.56751 9.65934 6.1158 9.25759 3.65199 numMergedOcc 0
