0 mol 7 unq 0 iso 0 dist 6.22892 15.5737 9.68596 12.1855 9.87885 10.1841 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.22805 13.6771 8.72114 12.2255 9.67164 5.5683 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.35095 8.7316 8.70827 5.06352 6.6219 4.04519 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.35095 8.7316 8.70827 7.63533 5.68215 13.7009 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.35095 10.9987 6.73939 5.06352 6.6219 12.5545 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.35095 10.9987 6.73939 7.63533 5.68215 4.08755 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 5.87895 5.076 9.12854 6.87351 8.87744 9.86385 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 5.87895 5.076 9.12854 7.79018 7.27472 10.4353 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 8.23292 14.4951 7.45383 11.7739 7.52933 11.0227 numMergedOcc 0
9 mol 25 unq 1 iso 0 dist 8.23292 14.4951 7.45383 13.0315 6.55597 4.98822 numMergedOcc 0
10 mol 25 unq 2 iso 0 dist 8.23292 14.4951 7.45383 9.6847 9.71956 10.3547 numMergedOcc 0
11 mol 25 unq 3 iso 0 dist 8.23292 14.4951 7.45383 9.50063 7.07751 7.91914 numMergedOcc 0
12 mol 25 unq 4 iso 0 dist 8.23292 14.4951 7.45383 9.6251 8.23761 11.7069 numMergedOcc 0
13 mol 25 unq 5 iso 0 dist 8.23292 14.4951 7.45383 10.985 9.49421 9.62058 numMergedOcc 0
14 mol 25 unq 6 iso 0 dist 8.23292 6.39668 9.01548 11.7739 7.52933 15.1255 numMergedOcc 0
15 mol 25 unq 7 iso 0 dist 8.23292 6.39668 9.01548 13.0315 6.55597 13.4321 numMergedOcc 0
16 mol 25 unq 8 iso 0 dist 8.23292 6.39668 9.01548 9.6847 9.71956 8.84447 numMergedOcc 0
17 mol 25 unq 9 iso 0 dist 8.23292 6.39668 9.01548 9.50063 7.07751 9.66912 numMergedOcc 0
18 mol 25 unq 10 iso 0 dist 8.23292 6.39668 9.01548 9.6251 8.23761 13.1117 numMergedOcc 0
19 mol 25 unq 11 iso 0 dist 8.23292 6.39668 9.01548 10.985 9.49421 5.38592 numMergedOcc 0
20 mol 30 unq 0 iso 0 dist 8.37503 7.07473 8.1284 10.5203 6.74179 4.98558 numMergedOcc 0
21 mol 54 unq 0 iso 0 dist 8.62769 11.1809 7.07339 5.17091 7.16132 7.06251 numMergedOcc 0
22 mol 54 unq 1 iso 0 dist 8.62769 7.13002 7.23317 5.17091 7.16132 3.81228 numMergedOcc 0
23 mol 54 unq 2 iso 0 dist 6.09782 6.11075 7.07339 10.763 7.16132 7.06251 numMergedOcc 0
24 mol 54 unq 3 iso 0 dist 6.09782 8.4509 7.23317 10.763 7.16132 3.81228 numMergedOcc 0
25 mol 59 unq 0 iso 0 dist 6.46655 7.02802 8.08618 9.85425 6.56212 5.56986 numMergedOcc 0
26 mol 68 unq 0 iso 0 dist 7.45675 9.7068 7.26024 11.3486 6.17207 3.85627 numMergedOcc 0
27 mol 68 unq 1 iso 0 dist 7.45675 5.9436 6.36086 11.3486 6.17207 7.15683 numMergedOcc 0
28 mol 95 unq 0 iso 0 dist 8.26838 9.61054 9.49454 8.32734 8.27883 15.7954 numMergedOcc 0
29 mol 95 unq 1 iso 0 dist 8.26838 9.61054 9.49454 4.79063 5.75428 10.4348 numMergedOcc 0
30 mol 95 unq 2 iso 0 dist 8.26838 9.61054 9.49454 4.05985 8.57395 5.88327 numMergedOcc 0
31 mol 95 unq 3 iso 0 dist 8.26838 9.61054 9.49454 12.6917 9.85409 3.96826 numMergedOcc 0
32 mol 133 unq 0 iso 0 dist 7.15203 5.86611 7.71248 5.94578 8.26547 8.88402 numMergedOcc 0
33 mol 143 unq 0 iso 0 dist 7.5984 11.4055 7.78652 14.6282 7.36975 12.207 numMergedOcc 0
34 mol 143 unq 1 iso 0 dist 7.5984 11.4055 7.78652 7.11802 5.40637 10.0079 numMergedOcc 0
35 mol 143 unq 2 iso 0 dist 7.5984 9.54731 8.91301 14.6282 7.36975 14.7271 numMergedOcc 0
36 mol 143 unq 3 iso 0 dist 7.5984 9.54731 8.91301 7.11802 5.40637 9.05366 numMergedOcc 0
37 mol 152 unq 0 iso 0 dist 6.98781 5.56412 6.46461 6.78963 6.41689 3.87512 numMergedOcc 0
38 mol 186 unq 0 iso 0 dist 7.45401 6.0361 8.73217 5.85073 6.61112 4.03697 numMergedOcc 0
39 mol 204 unq 0 iso 0 dist 7.7292 16.5925 9.68728 5.99091 7.9133 14.0756 numMergedOcc 0
40 mol 204 unq 1 iso 0 dist 6.27396 7.76353 9.1458 5.22975 5.94972 4.15888 numMergedOcc 0
41 mol 219 unq 0 iso 0 dist 9.68515 4.06981 7.59632 9.32356 4.33238 5.75906 numMergedOcc 0
42 mol 219 unq 1 iso 0 dist 8.09769 6.66401 7.59632 4.74338 4.33238 5.75906 numMergedOcc 0
43 mol 219 unq 2 iso 0 dist 6.75833 9.30251 7.59632 6.17123 4.33238 5.75906 numMergedOcc 0
44 mol 222 unq 0 iso 0 dist 7.27481 13.0565 9.07471 12.9462 6.74196 4.67663 numMergedOcc 0
45 mol 222 unq 1 iso 0 dist 7.27481 13.0565 9.07471 9.50604 8.36842 6.37382 numMergedOcc 0
46 mol 222 unq 2 iso 0 dist 7.27481 13.0565 9.07471 9.68195 9.75472 6.31322 numMergedOcc 0
47 mol 223 unq 0 iso 0 dist 9.94212 10.5593 7.48463 8.1388 6.42257 10.5752 numMergedOcc 0
48 mol 223 unq 1 iso 0 dist 9.94212 10.5593 7.48463 14.288 9.33543 3.86668 numMergedOcc 0
49 mol 232 unq 0 iso 0 dist 7.47238 15.5413 9.05071 6.2559 6.71524 11.2243 numMergedOcc 0
50 mol 259 unq 0 iso 0 dist 6.96379 7.39099 7.98231 8.41608 9.46361 4.10176 numMergedOcc 0
51 mol 284 unq 0 iso 0 dist 7.34344 6.50962 6.78191 12.1528 5.83329 8.8835 numMergedOcc 0
