0 mol 13 unq 0 iso 0 dist 7.68531 8.66515 5.58571 5.27699 7.44816 7.42612 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 4.73829 8.1717 8.03385 4.73978 6.44791 12.5176 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 7.39252 9.55065 10.6815 4.67713 9.80958 12.8484 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 9.61137 7.94697 5.89527 11.8972 7.19581 11.5303 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 7.06322 4.99934 3.35244 9.85159 7.02709 9.45682 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 8.29371 9.27028 8.9451 4.83846 5.94552 7.02367 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 5.6738 6.38269 4.62493 11.224 5.82487 9.4359 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 5.6738 7.11196 6.47997 11.224 5.82487 11.2964 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.27087 6.32254 5.64063 7.68038 6.32146 9.66404 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 7.71329 8.89556 5.64063 4.68256 6.32146 9.66404 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.99965 8.94445 3.93866 5.48717 9.83935 11.3735 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 5.9811 8.34984 9.47332 5.34337 9.29422 9.19385 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 6.26195 8.86773 5.7139 7.6323 7.98028 12.1509 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 6.26195 8.86773 5.7139 6.30874 5.8473 11.3432 numMergedOcc 0
14 mol 258 unq 2 iso 0 dist 6.26195 8.95095 4.05528 7.6323 7.98028 6.76495 numMergedOcc 0
15 mol 258 unq 3 iso 0 dist 6.26195 8.95095 4.05528 6.30874 5.8473 5.4557 numMergedOcc 0
16 mol 281 unq 0 iso 0 dist 8.9745 6.22003 5.52172 10.7592 6.49441 10.8282 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.64453 7.96707 3.39991 16.3901 9.29241 11.5975 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.64453 7.96707 3.39991 16.3901 9.29241 11.5975 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.64453 7.96707 3.39991 16.3901 9.29241 11.5975 numMergedOcc 0
