0 mol 17 unq 0 iso 0 dist 5.4572 10.374 9.26171 10.9811 5.82492 9.87179 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.14653 12.8342 8.96154 6.59687 6.32776 7.82759 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 7.01149 6.10172 6.89022 8.85672 10.3846 7.62814 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 9.13904 6.524 5.16779 7.18661 4.95433 4.77363 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 7.10245 6.524 6.69121 7.18661 5.26505 4.77363 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 9.43033 8.75597 5.38148 13.2578 7.01429 8.0933 numMergedOcc 0
6 mol 123 unq 1 iso 0 dist 8.57379 7.36026 6.63094 14.0466 7.40378 8.0933 numMergedOcc 0
7 mol 123 unq 2 iso 0 dist 5.87154 6.45068 8.24171 12.7274 12.1655 8.0933 numMergedOcc 0
8 mol 123 unq 3 iso 0 dist 6.82663 6.45068 6.63094 12.7274 7.40378 8.0933 numMergedOcc 0
9 mol 123 unq 4 iso 0 dist 9.93167 6.36283 5.38148 13.205 7.01429 8.0933 numMergedOcc 0
10 mol 231 unq 0 iso 0 dist 9.29492 8.52323 9.02803 13.6002 8.31171 6.8533 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 6.35781 11.2225 8.63893 17.2313 13.2785 7.38867 numMergedOcc 0
12 mol 254 unq 0 iso 0 dist 8.39401 10.459 6.56151 14.5094 6.89801 8.87934 numMergedOcc 0
13 mol 254 unq 1 iso 0 dist 8.39401 10.459 6.56151 16.2958 12.4202 9.47133 numMergedOcc 0
14 mol 254 unq 2 iso 0 dist 8.39401 11.1049 8.3417 14.5094 6.89801 9.66687 numMergedOcc 0
15 mol 254 unq 3 iso 0 dist 8.39401 11.1049 8.3417 16.2958 12.4202 7.61537 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 5.85932 9.52943 7.8647 9.86439 4.34203 9.90119 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 6.95272 5.55931 9.68335 10.8928 13.4292 8.22364 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.34771 8.2722 9.90494 11.6348 8.33215 9.33601 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 9.2825 8.2722 5.90121 11.6348 12.8409 9.33601 numMergedOcc 0
20 mol 283 unq 2 iso 0 dist 9.40332 5.93642 9.90494 13.0785 8.33215 9.33601 numMergedOcc 0
21 mol 283 unq 3 iso 0 dist 5.8676 5.93642 5.90121 13.0785 12.8409 9.33601 numMergedOcc 0
