0 mol 13 unq 0 iso 0 dist 9.22659 6.74124 8.00865 11.5443 13.1699 5.78148 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 9.22659 6.74124 8.00865 12.8587 10.5634 6.26071 numMergedOcc 0
2 mol 13 unq 2 iso 0 dist 9.22659 6.74124 8.00865 13.4084 8.66829 8.43325 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.05776 13.3842 8.98797 10.7264 11.2318 8.63486 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 7.60482 5.92019 5.86571 11.8625 10.9467 6.77886 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.87854 11.822 5.85818 14.5766 7.36192 7.99857 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 9.87854 11.822 5.85818 17.9511 10.6679 8.56342 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 8.15125 13.0339 9.87025 13.4745 6.35763 7.99857 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.15125 13.0339 9.87025 17.2484 10.0197 8.56342 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 8.16773 6.69527 8.43028 13.618 8.94259 8.93905 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 4.86894 4.88215 6.40901 8.72463 5.44503 8.41611 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 4.86894 8.25783 9.40626 8.72463 5.44503 7.63338 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 4.7785 3.97123 8.12589 11.2295 12.144 9.02318 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 4.7785 3.97123 8.12589 10.5375 10.2478 9.74542 numMergedOcc 0
14 mol 148 unq 2 iso 0 dist 4.7785 3.97123 8.12589 7.38138 6.29254 7.97543 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 4.79493 3.98367 8.11592 10.4957 10.2318 9.6606 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 4.79493 3.98367 8.11592 7.34423 6.25747 7.85526 numMergedOcc 0
17 mol 150 unq 2 iso 0 dist 4.79493 3.98367 8.11592 11.2386 12.154 8.94552 numMergedOcc 0
18 mol 159 unq 0 iso 0 dist 9.41487 7.80555 7.13269 11.8267 4.57561 7.25742 numMergedOcc 0
19 mol 192 unq 0 iso 0 dist 8.15486 6.93447 8.53433 9.05666 5.71262 7.24199 numMergedOcc 0
20 mol 198 unq 0 iso 0 dist 7.48163 4.75457 8.16598 12.9579 9.94078 9.18635 numMergedOcc 0
21 mol 198 unq 1 iso 0 dist 7.48163 4.75457 8.16598 9.4363 10.8191 8.10985 numMergedOcc 0
22 mol 198 unq 2 iso 0 dist 9.83627 10.3663 8.16598 17.4805 9.94078 9.18635 numMergedOcc 0
23 mol 198 unq 3 iso 0 dist 9.83627 10.3663 8.16598 15.3253 10.8191 8.10985 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 9.69953 9.55996 6.4829 10.9793 10.9823 7.63018 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 6.74861 8.62938 5.10114 6.83122 6.67959 6.38157 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 6.54661 6.12311 8.6597 9.2521 10.4664 5.64181 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 6.54661 6.12311 8.6597 8.51359 13.3539 7.61393 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.97261 6.12311 7.47235 9.2521 11.2717 5.64181 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 8.97261 6.12311 7.47235 8.51359 14.7509 7.61393 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 9.14992 7.3781 5.91208 12.0016 5.03393 5.64181 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 9.14992 7.3781 5.91208 9.41975 5.49433 7.61393 numMergedOcc 0
32 mol 248 unq 0 iso 0 dist 9.59898 9.43318 8.42446 10.3208 5.59351 6.77954 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 6.1535 9.81565 7.35433 10.7182 5.7074 9.05222 numMergedOcc 0
34 mol 282 unq 0 iso 0 dist 8.47112 6.6021 6.353 6.65024 5.9438 8.0241 numMergedOcc 0
35 mol 294 unq 0 iso 0 dist 5.81774 11.2327 8.32473 11.8926 6.17102 9.13907 numMergedOcc 0
