0 mol 18 unq 0 iso 0 dist 7.11979 8.63763 5.01478 9.60547 10.4086 8.80193 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 7.54869 7.84035 6.91765 7.33412 10.6808 6.30987 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 6.29729 7.84035 5.06052 7.33412 6.14538 6.30987 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.97123 8.79334 5.94559 7.69177 9.25641 7.46994 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 9.532 8.79334 9.32363 7.69177 14.4663 7.46994 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.09482 8.09032 13.1845 6.90704 10.2298 6.95465 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 8.92484 6.81647 6.01663 6.5924 12.2057 9.62236 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 8.92484 6.81647 6.01663 12.7341 9.72053 6.90634 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.70271 7.29853 12.0863 9.2212 12.817 7.41399 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 6.70271 7.29853 12.0863 7.9145 9.22232 8.21165 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 6.70271 7.29853 12.0863 7.10196 13.416 8.97945 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 6.70271 7.29853 12.0863 10.9892 17.1879 9.50664 numMergedOcc 0
12 mol 133 unq 4 iso 0 dist 6.70271 7.29853 12.0863 9.64181 16.1663 6.71555 numMergedOcc 0
13 mol 133 unq 5 iso 0 dist 6.2109 7.29853 9.53782 9.2212 14.4764 7.41399 numMergedOcc 0
14 mol 133 unq 6 iso 0 dist 6.2109 7.29853 9.53782 7.9145 12.7901 8.21165 numMergedOcc 0
15 mol 133 unq 7 iso 0 dist 6.2109 7.29853 9.53782 7.10196 11.8524 8.97945 numMergedOcc 0
16 mol 133 unq 8 iso 0 dist 6.2109 7.29853 9.53782 10.9892 10.9581 9.50664 numMergedOcc 0
17 mol 133 unq 9 iso 0 dist 6.2109 7.29853 9.53782 9.64181 12.5696 6.71555 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 6.94119 8.70753 8.22779 9.22614 10.4182 5.4997 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 6.94119 8.70753 8.22779 9.86393 13.5281 6.99693 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 6.7946 7.54847 13.5144 5.73136 10.716 9.22384 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 6.7946 7.54847 13.5144 7.83553 14.1471 8.08737 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 7.51284 6.47525 5.12409 4.51189 5.93616 5.91213 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 8.76025 6.23614 7.23534 5.8354 9.65934 5.59555 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 8.76025 6.23614 7.23534 5.8354 9.65934 5.59555 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.76025 6.23614 7.23534 5.8354 9.65934 5.59555 numMergedOcc 0
