0 mol 9 unq 0 iso 0 dist 3.71928 6.1339 8.01055 4.6016 4.75533 7.48843 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 3.71928 6.1339 8.01055 5.97672 5.85081 4.07023 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 3.71928 6.48158 8.61976 4.6016 4.75533 9.95911 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 3.71928 6.48158 8.61976 5.97672 5.85081 7.19188 numMergedOcc 0
4 mol 22 unq 0 iso 0 dist 7.74523 6.86436 9.32616 7.40116 6.59771 6.35459 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 9.21945 7.97622 8.9056 7.09261 8.79886 11.9221 numMergedOcc 0
6 mol 96 unq 1 iso 0 dist 5.5851 9.81613 8.9056 6.61175 8.79886 11.9221 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 8.74019 5.14974 6.53824 4.49297 9.12145 4.82514 numMergedOcc 0
8 mol 116 unq 1 iso 0 dist 8.74019 5.14974 6.53824 3.59945 8.11048 5.7646 numMergedOcc 0
9 mol 116 unq 2 iso 0 dist 8.74019 6.40614 6.61973 4.49297 9.12145 8.63935 numMergedOcc 0
10 mol 116 unq 3 iso 0 dist 8.74019 6.40614 6.61973 3.59945 8.11048 4.10222 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 6.78551 11.7558 8.9864 4.92712 4.821 7.33765 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 6.31232 8.28232 7.18976 12.3121 8.50362 5.3096 numMergedOcc 0
13 mol 157 unq 0 iso 0 dist 6.66184 7.20013 6.8976 4.15636 8.36016 5.07066 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 6.45502 13.5755 9.38856 13.3796 9.27714 3.91702 numMergedOcc 0
15 mol 158 unq 1 iso 0 dist 8.66056 12.9207 9.38856 10.7405 9.27714 3.91702 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 6.6514 8.3419 7.20545 4.0116 8.43955 6.87479 numMergedOcc 0
17 mol 174 unq 0 iso 0 dist 9.14165 9.23787 7.27146 6.66684 8.46317 5.30081 numMergedOcc 0
18 mol 174 unq 1 iso 0 dist 9.14165 4.98201 6.25798 6.66684 8.46317 5.41946 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 4.90334 7.84606 9.52029 5.96019 9.41594 9.47121 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 4.90334 7.84606 9.52029 8.84143 9.92651 11.8097 numMergedOcc 0
21 mol 204 unq 2 iso 0 dist 7.5696 9.55695 6.20044 13.4035 8.77524 6.42785 numMergedOcc 0
22 mol 204 unq 3 iso 0 dist 7.5696 7.67211 8.41232 13.4035 8.77524 7.66776 numMergedOcc 0
23 mol 204 unq 4 iso 0 dist 9.3369 13.6696 9.90757 5.77393 9.26192 11.1365 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.66533 13.587 4.36421 5.61704 9.53899 13.6384 numMergedOcc 0
25 mol 246 unq 0 iso 0 dist 4.7583 4.50365 8.16617 4.3708 9.03834 4.48822 numMergedOcc 0
26 mol 252 unq 0 iso 0 dist 9.31855 11.2871 8.19645 11.2225 9.09279 10.2121 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 9.10712 7.57685 7.90763 6.21674 9.51185 5.32967 numMergedOcc 0
28 mol 283 unq 0 iso 0 dist 6.89455 9.33643 9.28067 5.91899 5.38739 8.09099 numMergedOcc 0
29 mol 283 unq 1 iso 0 dist 8.07626 6.76599 9.28067 8.32685 5.38739 8.09099 numMergedOcc 0
30 mol 284 unq 0 iso 0 dist 5.62295 10.8669 7.74965 3.39008 8.2236 11.8933 numMergedOcc 0
31 mol 285 unq 0 iso 0 dist 8.73607 8.87977 7.872 12.8568 7.08681 11.2722 numMergedOcc 0
32 mol 285 unq 1 iso 0 dist 8.73607 8.87977 7.872 9.37808 4.95596 9.22192 numMergedOcc 0
33 mol 285 unq 2 iso 0 dist 8.73607 8.87977 7.872 12.6231 6.3508 8.37376 numMergedOcc 0
34 mol 285 unq 3 iso 0 dist 8.73607 8.87977 7.872 4.9035 8.3005 6.76283 numMergedOcc 0
35 mol 285 unq 4 iso 0 dist 8.73607 9.91326 6.32984 12.8568 7.08681 3.57803 numMergedOcc 0
36 mol 285 unq 5 iso 0 dist 8.73607 9.91326 6.32984 9.37808 4.95596 11.1099 numMergedOcc 0
37 mol 285 unq 6 iso 0 dist 8.73607 9.91326 6.32984 12.6231 6.3508 11.5761 numMergedOcc 0
38 mol 285 unq 7 iso 0 dist 8.73607 9.91326 6.32984 4.9035 8.3005 11.5053 numMergedOcc 0
39 mol 287 unq 0 iso 0 dist 9.11602 7.31462 8.40726 4.73745 9.77996 4.80377 numMergedOcc 0
40 mol 287 unq 1 iso 0 dist 9.11602 7.31462 8.40726 4.16431 6.61308 3.91371 numMergedOcc 0
41 mol 287 unq 2 iso 0 dist 9.11602 7.31462 8.40726 10.3443 6.25845 8.01657 numMergedOcc 0
42 mol 287 unq 3 iso 0 dist 9.11602 6.64598 5.15923 4.73745 9.77996 8.69518 numMergedOcc 0
43 mol 287 unq 4 iso 0 dist 9.11602 6.64598 5.15923 4.16431 6.61308 4.11753 numMergedOcc 0
44 mol 287 unq 5 iso 0 dist 9.11602 6.64598 5.15923 10.3443 6.25845 4.00861 numMergedOcc 0
45 mol 288 unq 0 iso 0 dist 9.11602 7.31462 8.40726 4.73745 9.77996 4.80377 numMergedOcc 0
46 mol 288 unq 1 iso 0 dist 9.11602 7.31462 8.40726 4.16431 6.61308 3.91371 numMergedOcc 0
47 mol 288 unq 2 iso 0 dist 9.11602 7.31462 8.40726 10.3443 6.25845 8.01657 numMergedOcc 0
48 mol 288 unq 3 iso 0 dist 9.11602 6.64598 5.15923 4.73745 9.77996 8.69518 numMergedOcc 0
49 mol 288 unq 4 iso 0 dist 9.11602 6.64598 5.15923 4.16431 6.61308 4.11753 numMergedOcc 0
50 mol 288 unq 5 iso 0 dist 9.11602 6.64598 5.15923 10.3443 6.25845 4.00861 numMergedOcc 0
51 mol 289 unq 0 iso 0 dist 9.11602 7.31462 8.40726 4.73745 9.77996 4.80377 numMergedOcc 0
52 mol 289 unq 1 iso 0 dist 9.11602 7.31462 8.40726 4.16431 6.61308 3.91371 numMergedOcc 0
53 mol 289 unq 2 iso 0 dist 9.11602 7.31462 8.40726 10.3443 6.25845 8.01657 numMergedOcc 0
54 mol 289 unq 3 iso 0 dist 9.11602 6.64598 5.15923 4.73745 9.77996 8.69518 numMergedOcc 0
55 mol 289 unq 4 iso 0 dist 9.11602 6.64598 5.15923 4.16431 6.61308 4.11753 numMergedOcc 0
56 mol 289 unq 5 iso 0 dist 9.11602 6.64598 5.15923 10.3443 6.25845 4.00861 numMergedOcc 0
