0 mol 26 unq 0 iso 0 dist 8.6112 9.70778 16.5552 10.5687 9.27369 15.7737 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 9.59503 8.95651 7.34488 12.49 5.93987 12.8424 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 9.59503 8.95651 7.34488 4.1125 7.7913 9.05259 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 9.57953 9.7171 5.74649 11.6508 9.13032 12.2596 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 7.84249 7.98999 13.6459 6.62328 6.09626 13.4033 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.72434 6.13391 6.00304 13.0801 8.4733 11.9591 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 8.43293 9.27951 4.63594 6.71699 8.73484 6.03352 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.12336 7.34386 11.3259 12.6435 6.72323 17.9953 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 7.7264 8.76152 5.61924 4.04072 7.81715 10.9494 numMergedOcc 0
9 mol 163 unq 1 iso 0 dist 7.7264 9.3832 15.0568 4.04072 7.81715 9.79069 numMergedOcc 0
10 mol 163 unq 2 iso 0 dist 7.5447 6.0247 3.64474 14.0837 9.62943 13.1233 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 8.59783 7.68295 5.31547 4.98945 6.21194 8.1536 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.4839 9.8594 9.36957 4.44432 9.30303 14.1687 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 9.70481 8.25343 9.26877 8.5937 9.30303 12.9311 numMergedOcc 0
14 mol 176 unq 2 iso 0 dist 6.59532 8.86094 9.26877 5.2357 9.30303 12.9311 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 5.86679 5.66593 4.2759 5.40441 8.55613 7.44706 numMergedOcc 0
16 mol 253 unq 0 iso 0 dist 5.86892 8.95991 5.57882 13.3151 9.34735 13.2005 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.64278 8.78354 5.67781 4.17741 9.58735 9.91199 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 6.15713 8.78354 4.88527 4.17741 8.12414 9.91199 numMergedOcc 0
19 mol 286 unq 0 iso 0 dist 5.03123 7.3415 6.77784 4.08297 8.23877 10.9416 numMergedOcc 0
