0 mol 10 unq 0 iso 0 dist 9.09015 5.24846 9.6309 10.2264 8.3613 13.2906 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.09015 7.83137 8.76873 10.2264 8.3613 11.4971 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.09015 9.24758 9.58981 10.2264 8.3613 6.38082 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 7.82815 8.51289 9.6309 9.20224 8.3613 13.2906 numMergedOcc 0
4 mol 10 unq 4 iso 0 dist 7.82815 3.98499 8.76873 9.20224 8.3613 11.4971 numMergedOcc 0
5 mol 10 unq 5 iso 0 dist 7.82815 4.75951 9.58981 9.20224 8.3613 6.38082 numMergedOcc 0
6 mol 10 unq 6 iso 0 dist 7.70383 5.24846 9.23414 10.2264 9.33141 13.2906 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 9.7649 8.97755 8.6586 17.7515 8.23075 13.2653 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 6.5268 7.14863 8.6586 14.2153 8.23075 13.2653 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.16745 6.41257 8.4515 5.78226 6.23522 3.97569 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.16745 6.41257 8.4515 6.34076 9.10566 12.4903 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 6.16745 6.41257 8.4515 10.9974 9.62027 5.99117 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.63792 4.35001 6.46582 8.18176 7.61521 8.78063 numMergedOcc 0
13 mol 95 unq 0 iso 0 dist 4.81841 4.98105 7.74924 6.56354 7.51733 5.77535 numMergedOcc 0
14 mol 95 unq 1 iso 0 dist 4.81841 4.98105 7.74924 6.68919 9.01607 9.35848 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.71568 4.28681 6.3323 10.6579 7.44558 11.1132 numMergedOcc 0
16 mol 109 unq 1 iso 0 dist 5.81859 8.86634 6.3323 6.24368 7.44558 11.1132 numMergedOcc 0
17 mol 117 unq 0 iso 0 dist 8.03867 4.01262 6.01857 10.6596 7.42146 11.1675 numMergedOcc 0
18 mol 117 unq 1 iso 0 dist 5.94465 8.64874 6.01857 6.3368 7.42146 11.1675 numMergedOcc 0
19 mol 120 unq 0 iso 0 dist 8.44206 10.1556 8.03124 5.0256 8.38358 6.81949 numMergedOcc 0
20 mol 120 unq 1 iso 0 dist 9.78884 12.3435 8.03124 8.66137 8.38358 6.81949 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 6.01995 7.49664 4.82356 4.90674 5.78814 4.84607 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 6.01995 14.1334 8.83476 4.90674 5.78814 11.981 numMergedOcc 0
23 mol 147 unq 0 iso 0 dist 8.94352 10.7499 8.76449 6.97147 6.73617 6.91778 numMergedOcc 0
24 mol 154 unq 0 iso 0 dist 8.50487 4.05045 8.26128 8.81984 8.89394 5.88662 numMergedOcc 0
25 mol 167 unq 0 iso 0 dist 8.0697 11.9696 8.95296 9.37794 5.36671 6.32863 numMergedOcc 0
26 mol 167 unq 1 iso 0 dist 8.0697 5.37536 6.10021 9.37794 5.36671 5.48405 numMergedOcc 0
27 mol 218 unq 0 iso 0 dist 9.08818 5.07198 7.68062 6.75711 6.1896 4.94196 numMergedOcc 0
28 mol 253 unq 0 iso 0 dist 8.58013 6.34554 8.71119 7.40932 9.19385 11.8779 numMergedOcc 0
29 mol 253 unq 1 iso 0 dist 8.58013 6.34554 8.71119 10.9466 9.1927 15.4152 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 4.98907 3.89286 6.61322 5.29393 8.03012 9.07364 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 9.89615 12.1091 8.25703 15.8358 8.12739 10.6892 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 5.77565 6.43955 8.25703 4.68199 8.12739 10.6892 numMergedOcc 0
33 mol 281 unq 0 iso 0 dist 9.05453 9.92739 6.82918 4.89583 5.50053 7.74992 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.17634 5.30118 7.19628 numMergedOcc 0
35 mol 287 unq 1 iso 0 dist 9.14217 10.3226 7.84189 7.78985 8.98698 11.7959 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.17634 5.30118 7.19628 numMergedOcc 0
37 mol 288 unq 1 iso 0 dist 9.14217 10.3226 7.84189 7.78985 8.98698 11.7959 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.17634 5.30118 7.19628 numMergedOcc 0
39 mol 289 unq 1 iso 0 dist 9.14217 10.3226 7.84189 7.78985 8.98698 11.7959 numMergedOcc 0
40 mol 294 unq 0 iso 0 dist 5.18334 11.4279 7.48987 9.07177 7.56669 5.57606 numMergedOcc 0
41 mol 294 unq 1 iso 0 dist 6.44588 9.32276 7.48987 5.08625 7.56669 5.57606 numMergedOcc 0
