0 mol 6 unq 0 iso 0 dist 9.53484 11.6399 8.15992 13.6464 5.27713 6.36157 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.71101 7.77928 4.75533 14.7109 7.48843 8.01055 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 7.71101 7.77928 4.75533 16.1243 9.95911 8.61976 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 5.32613 8.61141 4.75533 12.6691 7.48843 8.01055 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 5.32613 8.61141 4.75533 15.2562 9.95911 8.61976 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 9.2795 5.05514 8.70331 11.925 4.52962 9.28158 numMergedOcc 0
6 mol 42 unq 0 iso 0 dist 8.98545 10.2834 7.53194 9.50568 4.62559 5.52834 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 6.72584 13.468 7.69755 7.6104 4.48523 7.2118 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 8.66819 10.9008 8.91998 13.2262 10.8497 8.91354 numMergedOcc 0
9 mol 91 unq 1 iso 0 dist 8.47126 14.1047 8.91998 12.1432 10.8497 8.91354 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.84085 6.92975 9.35049 6.29879 4.63862 5.79195 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.99127 12.8171 5.33772 10.8089 3.66518 5.40826 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 6.74196 7.23314 5.93144 14.0238 11.5982 6.85551 numMergedOcc 0
13 mol 165 unq 1 iso 0 dist 6.72652 10.0295 5.93144 16.7466 11.5982 6.85551 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 7.33483 4.72853 8.43955 6.26373 6.87479 7.20545 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.00278 9.42629 8.77524 9.7707 6.42785 6.20044 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 7.00278 9.42629 8.77524 13.4764 7.66776 8.41232 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.72463 5.87078 7.95917 6.61789 4.68656 8.05949 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.71467 16.9963 9.46274 22.6002 14.085 5.86911 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 9.71467 16.9963 9.46274 21.6616 12.4498 7.89258 numMergedOcc 0
20 mol 214 unq 2 iso 0 dist 6.03628 10.8341 9.46274 16.5544 14.085 5.86911 numMergedOcc 0
21 mol 214 unq 3 iso 0 dist 6.03628 10.8341 9.46274 16.1376 12.4498 7.89258 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 6.32658 8.73111 6.62413 8.9309 4.49386 3.67935 numMergedOcc 0
23 mol 249 unq 1 iso 0 dist 6.32658 8.73111 6.62413 10.1294 5.33399 8.00386 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 8.4346 4.61312 5.83039 10.1816 5.9731 9.54511 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 7.97728 4.61312 6.74364 10.1816 3.69576 9.54511 numMergedOcc 0
26 mol 257 unq 0 iso 0 dist 6.19418 6.35062 8.23073 8.36731 3.67174 8.09912 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 8.3872 9.49668 9.30035 8.19595 5.32967 6.69245 numMergedOcc 0
28 mol 272 unq 1 iso 0 dist 8.3872 4.36153 9.51185 8.19595 5.32967 7.90763 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 6.17759 9.16384 9.77996 9.40407 4.80377 8.40726 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 6.17759 9.16384 9.77996 10.7644 8.69518 5.15923 numMergedOcc 0
31 mol 287 unq 2 iso 0 dist 8.20391 9.16384 6.61308 9.40407 3.91371 8.40726 numMergedOcc 0
32 mol 287 unq 3 iso 0 dist 8.20391 9.16384 6.61308 10.7644 4.11753 5.15923 numMergedOcc 0
33 mol 288 unq 0 iso 0 dist 6.17759 9.16384 9.77996 9.40407 4.80377 8.40726 numMergedOcc 0
34 mol 288 unq 1 iso 0 dist 6.17759 9.16384 9.77996 10.7644 8.69518 5.15923 numMergedOcc 0
35 mol 288 unq 2 iso 0 dist 8.20391 9.16384 6.61308 9.40407 3.91371 8.40726 numMergedOcc 0
36 mol 288 unq 3 iso 0 dist 8.20391 9.16384 6.61308 10.7644 4.11753 5.15923 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 6.17759 9.16384 9.77996 9.40407 4.80377 8.40726 numMergedOcc 0
38 mol 289 unq 1 iso 0 dist 6.17759 9.16384 9.77996 10.7644 8.69518 5.15923 numMergedOcc 0
39 mol 289 unq 2 iso 0 dist 8.20391 9.16384 6.61308 9.40407 3.91371 8.40726 numMergedOcc 0
40 mol 289 unq 3 iso 0 dist 8.20391 9.16384 6.61308 10.7644 4.11753 5.15923 numMergedOcc 0
