0 mol 9 unq 0 iso 0 dist 8.77074 11.5622 8.29595 11.1857 8.55446 16.5531 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.77074 11.5622 8.29595 9.93406 6.59455 14.2823 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.77074 11.5622 8.29595 13.0985 5.71201 11.69 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 9.23241 6.76039 8.83047 10.4112 7.75295 12.4655 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 9.23241 14.2926 6.95013 10.4112 7.75295 7.96384 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 5.9644 11.2919 9.16658 3.72318 5.53589 7.8821 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.53468 9.70734 8.91206 4.79924 7.62738 6.41591 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.53468 5.41551 8.67513 4.79924 7.62738 9.55939 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 5.90954 9.93198 8.91206 9.80492 7.62738 6.41591 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 5.90954 5.54987 8.67513 9.80492 7.62738 9.55939 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 6.92225 5.52015 7.24115 4.31531 6.76055 9.21335 numMergedOcc 0
11 mol 158 unq 1 iso 0 dist 6.92225 5.52015 7.24115 9.29425 9.36343 13.1807 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 8.12896 5.02465 6.96572 10.595 7.8639 9.55101 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 8.88092 11.6445 6.96572 7.26899 7.8639 9.55101 numMergedOcc 0
14 mol 163 unq 2 iso 0 dist 9.3832 17.2409 9.29539 4.04072 9.79069 15.8699 numMergedOcc 0
15 mol 163 unq 3 iso 0 dist 9.3832 17.2409 9.29539 16.9342 9.27496 6.48748 numMergedOcc 0
16 mol 163 unq 4 iso 0 dist 9.3832 14.7097 9.02124 4.04072 9.79069 17.0667 numMergedOcc 0
17 mol 163 unq 5 iso 0 dist 9.3832 14.7097 9.02124 16.9342 9.27496 15.7737 numMergedOcc 0
18 mol 163 unq 6 iso 0 dist 6.0247 8.52732 9.29539 12.5525 9.79069 15.8699 numMergedOcc 0
19 mol 163 unq 7 iso 0 dist 6.0247 8.52732 9.29539 4.37572 9.27496 6.48748 numMergedOcc 0
20 mol 163 unq 8 iso 0 dist 6.0247 12.8414 9.02124 12.5525 9.79069 17.0667 numMergedOcc 0
21 mol 163 unq 9 iso 0 dist 6.0247 12.8414 9.02124 4.37572 9.27496 15.7737 numMergedOcc 0
22 mol 163 unq 10 iso 0 dist 6.40873 10.0505 9.29539 8.81556 9.79069 15.8699 numMergedOcc 0
23 mol 163 unq 11 iso 0 dist 6.40873 10.0505 9.29539 7.05786 9.27496 6.48748 numMergedOcc 0
24 mol 163 unq 12 iso 0 dist 6.40873 14.9092 9.02124 8.81556 9.79069 17.0667 numMergedOcc 0
25 mol 163 unq 13 iso 0 dist 6.40873 14.9092 9.02124 7.05786 9.27496 15.7737 numMergedOcc 0
26 mol 171 unq 0 iso 0 dist 7.68295 5.24208 6.81707 4.98945 8.1536 6.4423 numMergedOcc 0
27 mol 173 unq 0 iso 0 dist 5.76772 4.52935 7.70692 5.04427 8.03528 6.34062 numMergedOcc 0
28 mol 194 unq 0 iso 0 dist 7.47107 14.7761 8.63008 10.7677 5.68348 4.44921 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 7.53138 8.54852 7.60925 5.90077 9.72138 5.8971 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 5.31079 6.60799 9.3439 6.5238 6.51288 9.91189 numMergedOcc 0
31 mol 243 unq 0 iso 0 dist 5.66593 5.80426 8.54245 5.40441 7.44706 9.97818 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.39659 5.57126 9.54884 6.00136 9.53943 10.8812 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 8.36282 14.2164 7.11691 10.2848 9.18635 8.64133 numMergedOcc 0
34 mol 279 unq 0 iso 0 dist 5.63154 13.1905 8.84798 11.7377 9.30921 10.8394 numMergedOcc 0
