0 mol 1 unq 0 iso 0 dist 9.40771 6.13271 6.86701 11.399 5.06184 6.4181 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.7275 9.02078 6.86701 8.40848 5.06184 6.4181 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 6.12374 6.12182 7.26639 9.49676 5.96514 5.73067 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.86485 7.71984 9.22598 5.35101 4.99692 6.36193 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.86485 4.67517 8.96727 5.35101 4.99692 4.88613 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 8.37546 4.67517 8.01308 5.35101 3.70586 4.88613 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 9.76234 12.5529 9.22598 8.68381 4.99692 6.36193 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 9.76234 8.47822 8.96727 8.68381 4.99692 4.88613 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 6.89527 6.27668 8.3733 5.16558 3.77705 9.46247 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 9.77648 8.93735 5.99857 12.4371 4.69809 5.47319 numMergedOcc 0
10 mol 69 unq 1 iso 0 dist 9.77648 12.4431 6.9362 12.4371 4.69809 9.8809 numMergedOcc 0
11 mol 69 unq 2 iso 0 dist 9.18161 5.08122 5.99857 7.17678 4.69809 5.47319 numMergedOcc 0
12 mol 69 unq 3 iso 0 dist 9.18161 9.69519 6.9362 7.17678 4.69809 9.8809 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 8.18572 13.7055 8.13108 11.0237 6.69911 9.71952 numMergedOcc 0
14 mol 76 unq 1 iso 0 dist 8.18572 13.7055 8.13108 10.9708 3.94216 7.28257 numMergedOcc 0
15 mol 95 unq 0 iso 0 dist 9.77082 15.821 9.3948 10.4065 8.55456 9.65047 numMergedOcc 0
16 mol 95 unq 1 iso 0 dist 8.0675 9.7565 9.3948 13.1768 8.55456 9.65047 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 6.17349 6.86762 7.69765 8.21127 5.33827 5.02717 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 9.21978 6.86762 9.42082 8.21127 12.6105 5.02717 numMergedOcc 0
19 mol 129 unq 0 iso 0 dist 8.4375 5.57978 6.69691 14.6058 9.63308 9.28278 numMergedOcc 0
20 mol 129 unq 1 iso 0 dist 8.62413 5.57978 5.51197 14.6058 9.05571 9.28278 numMergedOcc 0
21 mol 129 unq 2 iso 0 dist 6.93102 5.57978 8.86944 14.6058 14.5546 9.28278 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 7.33743 6.80087 8.77023 5.7232 11.5628 5.82404 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.83476 5.49497 6.64173 13.8473 7.19461 9.84952 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.28282 11.3614 7.2793 15.6713 11.8169 8.03995 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 7.81696 7.37734 7.85184 4.85577 3.85767 8.03995 numMergedOcc 0
26 mol 197 unq 0 iso 0 dist 9.67667 9.73282 9.10817 16.7666 17.2264 8.3337 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 8.79662 13.3218 7.48954 12.3791 5.96186 7.85877 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 6.66615 5.2836 5.90924 9.7641 3.63202 7.36905 numMergedOcc 0
29 mol 264 unq 1 iso 0 dist 6.66615 13.628 9.58916 9.7641 3.63202 6.83408 numMergedOcc 0
