0 mol 18 unq 0 iso 0 dist 6.90688 9.04157 6.40425 13.9547 13.6905 7.94376 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 6.19716 6.45955 7.70687 9.60691 14.8737 8.99536 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 6.19716 6.45955 7.70687 6.20826 10.3916 5.94317 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 6.07392 9.75749 6.74231 15.6669 14.9121 8.99451 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 4.35437 5.52904 4.67883 7.6026 7.31784 8.61893 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 6.91361 5.61418 10.4429 10.8137 10.8254 7.54574 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.38498 6.3646 9.53672 10.6827 11.9591 6.21165 numMergedOcc 0
7 mol 135 unq 0 iso 0 dist 5.06602 6.08242 6.66299 4.75453 8.83856 7.02963 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 6.89591 5.55632 4.83835 6.71173 6.51014 8.90588 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 9.84445 6.18165 14.1568 15.414 23.1223 9.84538 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 9.07517 9.28442 5.43768 14.5516 14.8296 9.9042 numMergedOcc 0
11 mol 193 unq 1 iso 0 dist 9.07517 9.28442 5.43768 11.2251 8.43187 6.21262 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 6.51617 8.86773 10.1436 5.0607 10.7256 8.31526 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 6.51617 8.95095 10.6472 5.0607 10.7256 7.08328 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.09112 7.22473 5.42399 4.48112 7.99521 6.49413 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 8.09112 6.02628 10.39 4.48112 7.99521 6.12343 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 7.31866 7.13397 11.3153 5.72956 12.8401 6.49413 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 7.31866 5.33278 11.1238 5.72956 12.8401 4.52405 numMergedOcc 0
18 mol 260 unq 4 iso 0 dist 5.6002 7.13397 5.42399 5.72956 7.99521 6.49413 numMergedOcc 0
19 mol 260 unq 5 iso 0 dist 5.6002 5.33278 9.79316 5.72956 7.99521 4.52405 numMergedOcc 0
