0 mol 25 unq 0 iso 0 dist 8.94828 6.60191 8.46842 4.54526 4.79873 5.03904 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.94828 6.60191 8.46842 16.0229 9.48085 16.8735 numMergedOcc 0
2 mol 112 unq 0 iso 0 dist 7.85583 9.58185 9.13413 10.864 8.47988 11.7536 numMergedOcc 0
3 mol 112 unq 1 iso 0 dist 7.85583 9.58185 9.13413 9.95307 8.0427 5.8662 numMergedOcc 0
4 mol 112 unq 2 iso 0 dist 8.86938 13.8988 9.13413 9.50897 8.47988 11.7536 numMergedOcc 0
5 mol 112 unq 3 iso 0 dist 8.86938 13.8988 9.13413 11.9673 8.0427 5.8662 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.00172 11.693 7.85025 7.44092 8.77023 13.4842 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 5.50687 5.84146 7.31419 4.4987 5.35237 6.4405 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 5.50687 5.84146 7.31419 4.72407 8.70621 3.64555 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.77347 6.72843 5.47189 8.69152 6.61112 6.7954 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.18446 7.6839 7.18765 9.66766 9.10817 4.26432 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 6.18446 7.6839 7.18765 7.69814 9.73548 14.0652 numMergedOcc 0
12 mol 197 unq 2 iso 0 dist 9.96544 7.6839 7.41091 9.66766 6.86828 4.26432 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 6.22964 7.72978 6.18991 10.9033 9.21377 4.10207 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 6.22964 6.21219 8.68547 10.9033 9.21377 7.03848 numMergedOcc 0
15 mol 218 unq 0 iso 0 dist 9.79816 6.61764 9.95084 15.4347 7.33709 13.8104 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 7.57253 5.04399 6.94983 8.96601 6.71524 7.30782 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 6.48196 5.36235 4.94074 5.17683 8.51625 7.83075 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 8.97461 5.83394 9.09166 17.3901 9.08509 17.7087 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 6.26533 8.41952 9.13483 4.45177 6.34915 6.16483 numMergedOcc 0
20 mol 257 unq 1 iso 0 dist 6.26533 5.44976 5.16581 4.45177 6.34915 5.48725 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 8.85887 3.98643 6.66602 12.6528 9.58916 12.6107 numMergedOcc 0
22 mol 264 unq 1 iso 0 dist 6.65233 5.92877 6.20796 6.04707 8.29262 4.66338 numMergedOcc 0
23 mol 264 unq 2 iso 0 dist 6.65233 9.60654 7.73693 6.04707 8.29262 10.3972 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 7.151 7.90123 5.22392 10.3171 9.57499 6.68571 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 8.53324 6.5109 8.23147 10.3171 5.46926 6.40883 numMergedOcc 0
26 mol 277 unq 2 iso 0 dist 8.53324 6.5109 8.23147 10.6814 5.13913 6.79352 numMergedOcc 0
27 mol 277 unq 3 iso 0 dist 8.53324 7.90123 8.20217 10.3171 5.46926 6.68571 numMergedOcc 0
28 mol 277 unq 4 iso 0 dist 8.53324 7.90123 8.20217 10.6814 5.13913 9.44642 numMergedOcc 0
29 mol 277 unq 5 iso 0 dist 7.23956 13.4588 6.86014 8.60807 9.35539 11.4058 numMergedOcc 0
30 mol 277 unq 6 iso 0 dist 7.23956 13.4588 6.86014 10.3171 8.9682 14.6762 numMergedOcc 0
31 mol 277 unq 7 iso 0 dist 7.23956 13.4588 6.86014 10.6814 6.92711 11.68 numMergedOcc 0
32 mol 277 unq 8 iso 0 dist 7.23956 6.34637 5.97073 8.60807 9.35539 6.9003 numMergedOcc 0
33 mol 277 unq 9 iso 0 dist 7.23956 6.34637 5.97073 10.3171 8.9682 11.3103 numMergedOcc 0
34 mol 277 unq 10 iso 0 dist 7.23956 6.34637 5.97073 10.6814 6.92711 10.5734 numMergedOcc 0
35 mol 277 unq 11 iso 0 dist 7.23956 6.5109 6.49176 8.60807 9.35539 11.7592 numMergedOcc 0
36 mol 277 unq 12 iso 0 dist 7.23956 6.5109 6.49176 10.3171 8.9682 6.40883 numMergedOcc 0
37 mol 277 unq 13 iso 0 dist 7.23956 6.5109 6.49176 10.6814 6.92711 6.79352 numMergedOcc 0
38 mol 277 unq 14 iso 0 dist 8.33977 4.10842 5.22392 5.04761 9.57499 6.68571 numMergedOcc 0
39 mol 277 unq 15 iso 0 dist 8.66941 8.42001 8.23147 5.04761 5.46926 6.40883 numMergedOcc 0
40 mol 277 unq 16 iso 0 dist 8.66941 8.42001 8.23147 8.42957 5.13913 6.79352 numMergedOcc 0
41 mol 277 unq 17 iso 0 dist 8.66941 4.10842 8.20217 5.04761 5.46926 6.68571 numMergedOcc 0
42 mol 277 unq 18 iso 0 dist 8.66941 4.10842 8.20217 8.42957 5.13913 9.44642 numMergedOcc 0
