0 mol 7 unq 0 iso 0 dist 5.72491 9.67164 8.0744 10.515 7.45262 8.81608 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.88043 5.99459 8.0744 6.06176 7.45262 8.81608 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.80762 5.99459 11.7002 6.06176 6.96586 8.81608 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 7.55766 5.65084 4.8604 7.04695 9.4753 5.04478 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 6.90155 9.48085 13.7717 12.1492 18.7238 8.53931 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 6.6492 9.49421 11.7199 4.70708 8.5404 8.53931 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.72642 9.42082 10.5109 10.9739 14.0242 8.0168 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.99857 6.99446 6.29394 6.35763 9.87025 6.13374 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 7.99857 6.99446 6.29394 7.36192 5.85818 9.08536 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 8.56342 7.64052 6.29394 10.0197 9.87025 6.13374 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.56342 7.64052 6.29394 10.6679 5.85818 9.08536 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 6.37542 7.64052 9.64502 10.0197 14.5497 6.13374 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 6.37542 7.64052 9.64502 10.6679 13.4689 9.08536 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 8.41611 7.36975 9.05786 6.01455 13.143 7.05845 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 8.41611 7.36975 9.05786 5.44503 6.40901 8.18023 numMergedOcc 0
15 mol 143 unq 2 iso 0 dist 8.41611 5.40637 6.16103 5.44503 6.40901 7.46803 numMergedOcc 0
16 mol 143 unq 3 iso 0 dist 7.63338 7.36975 3.75378 6.01455 8.1582 7.05845 numMergedOcc 0
17 mol 143 unq 4 iso 0 dist 7.63338 7.36975 3.75378 5.44503 9.40626 8.18023 numMergedOcc 0
18 mol 143 unq 5 iso 0 dist 7.63338 5.40637 8.4697 5.44503 9.40626 7.46803 numMergedOcc 0
19 mol 143 unq 6 iso 0 dist 9.03707 7.36975 14.0356 6.01455 12.5074 7.05845 numMergedOcc 0
20 mol 143 unq 7 iso 0 dist 9.03707 7.36975 14.0356 5.44503 12.6197 8.18023 numMergedOcc 0
21 mol 143 unq 8 iso 0 dist 9.03707 5.40637 5.41614 5.44503 12.6197 7.46803 numMergedOcc 0
22 mol 143 unq 9 iso 0 dist 7.25673 7.36975 9.30534 6.01455 7.88655 7.05845 numMergedOcc 0
23 mol 143 unq 10 iso 0 dist 7.25673 7.36975 9.30534 5.44503 11.7726 8.18023 numMergedOcc 0
24 mol 143 unq 11 iso 0 dist 7.25673 5.40637 6.78032 5.44503 11.7726 7.46803 numMergedOcc 0
25 mol 184 unq 0 iso 0 dist 8.77887 6.73504 6.19242 6.47974 6.21206 7.59939 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 6.38157 7.46481 5.73082 6.67959 5.10114 8.70987 numMergedOcc 0
27 mol 225 unq 0 iso 0 dist 6.6561 6.50998 6.35462 8.69249 5.13453 8.91356 numMergedOcc 0
28 mol 225 unq 1 iso 0 dist 6.6561 6.50998 6.35462 14.2819 15.3726 9.59574 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 7.5366 7.81215 11.0592 5.56749 12.5852 9.11572 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 7.5366 7.81215 11.0592 15.015 20.199 9.49229 numMergedOcc 0
31 mol 234 unq 2 iso 0 dist 7.5366 7.81215 11.0592 12.1076 17.4956 7.20293 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 7.32982 9.72188 13.0611 15.5674 13.8085 9.84652 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 5.52379 9.07475 6.50998 10.0613 11.7654 9.82327 numMergedOcc 0
34 mol 238 unq 2 iso 0 dist 5.52379 6.99888 5.63944 5.54325 6.89694 5.43613 numMergedOcc 0
35 mol 238 unq 3 iso 0 dist 5.52379 6.99888 5.63944 10.0613 11.7654 7.06768 numMergedOcc 0
36 mol 238 unq 4 iso 0 dist 5.64181 9.08509 6.94907 5.17471 6.44735 5.43613 numMergedOcc 0
37 mol 238 unq 5 iso 0 dist 5.64181 9.08509 6.94907 5.03393 5.91208 7.06768 numMergedOcc 0
38 mol 248 unq 0 iso 0 dist 6.17052 9.05018 7.14182 6.48757 8.53148 5.0345 numMergedOcc 0
39 mol 259 unq 0 iso 0 dist 8.55558 5.85442 7.32929 5.79468 6.39918 6.23661 numMergedOcc 0
40 mol 259 unq 1 iso 0 dist 8.59697 8.03219 4.67584 5.31048 6.39918 8.84648 numMergedOcc 0
41 mol 259 unq 2 iso 0 dist 8.59697 6.9899 7.32929 5.31048 6.39918 6.23661 numMergedOcc 0
42 mol 274 unq 0 iso 0 dist 7.4099 6.4611 13.4431 5.31116 11.6675 6.66172 numMergedOcc 0
