0 mol 4 unq 0 iso 0 dist 5.39008 12.7044 9.12428 6.10734 5.12621 8.24634 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 5.39008 12.7044 9.12428 15.6929 14.8379 9.16617 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 5.39008 12.7044 9.12428 17.7704 15.2242 8.87255 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 6.96907 5.12111 5.68648 11.2151 9.35502 7.03958 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.67459 9.69698 8.03754 16.0184 11.3298 8.95682 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.7939 10.3774 7.23812 14.1293 14.7042 9.24757 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.44695 12.6626 7.23812 21.4221 14.7042 9.24757 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 5.68894 9.64124 7.23812 17.6925 14.7042 9.24757 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 9.83234 4.6408 7.03536 12.988 11.1037 9.30539 numMergedOcc 0
9 mol 91 unq 1 iso 0 dist 9.83234 4.6408 7.03536 12.9493 4.43042 9.01176 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.26325 6.65856 6.42706 15.008 13.0193 9.36851 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 7.26325 6.65856 6.42706 11.0726 8.03693 4.97175 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.82274 15.3123 9.1146 16.048 15.0618 9.22232 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 9.82274 15.3123 9.1146 18.0382 9.68947 9.22661 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 9.82274 15.3123 9.1146 14.7565 5.10826 7.56378 numMergedOcc 0
15 mol 133 unq 3 iso 0 dist 9.02712 10.4303 9.1146 9.93309 15.0618 9.22232 numMergedOcc 0
16 mol 133 unq 4 iso 0 dist 9.02712 10.4303 9.1146 16.8608 9.68947 9.22661 numMergedOcc 0
17 mol 133 unq 5 iso 0 dist 9.02712 10.4303 9.1146 11.0312 5.10826 7.56378 numMergedOcc 0
18 mol 155 unq 0 iso 0 dist 9.06599 4.97552 8.57712 10.9746 10.7516 6.53347 numMergedOcc 0
19 mol 156 unq 0 iso 0 dist 5.50879 10.9993 8.50926 8.32841 5.6621 9.00416 numMergedOcc 0
20 mol 156 unq 1 iso 0 dist 6.69157 4.75264 8.50926 6.56065 5.6621 9.00416 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 9.23669 15.0515 9.44947 13.4344 4.29037 9.68728 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 7.99609 5.01062 7.73634 13.4892 10.3035 9.07471 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 8.24741 12.6212 9.30975 6.82883 4.66376 8.80683 numMergedOcc 0
24 mol 226 unq 1 iso 0 dist 8.24741 10.78 9.14028 6.82883 4.66376 6.11704 numMergedOcc 0
25 mol 226 unq 2 iso 0 dist 5.07958 9.83787 9.30975 8.22518 4.66376 8.80683 numMergedOcc 0
26 mol 226 unq 3 iso 0 dist 5.07958 11.3247 9.14028 8.22518 4.66376 6.11704 numMergedOcc 0
27 mol 226 unq 4 iso 0 dist 6.19519 6.6871 9.30975 6.02803 4.66376 8.80683 numMergedOcc 0
28 mol 226 unq 5 iso 0 dist 6.19519 6.19485 9.14028 6.02803 4.66376 6.11704 numMergedOcc 0
29 mol 244 unq 0 iso 0 dist 6.2667 8.82711 9.21656 5.60146 4.89551 5.50492 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 7.51278 5.68749 8.98788 10.1331 6.71088 7.16525 numMergedOcc 0
31 mol 261 unq 0 iso 0 dist 7.3406 4.69366 5.00128 12.744 6.76449 8.43974 numMergedOcc 0
32 mol 261 unq 1 iso 0 dist 9.15672 4.69366 6.58604 12.744 7.91847 8.43974 numMergedOcc 0
33 mol 271 unq 0 iso 0 dist 5.76281 5.31774 9.42899 11.8112 11.0964 9.70714 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 7.85797 6.69098 9.37841 8.16005 4.73332 8.49177 numMergedOcc 0
35 mol 274 unq 0 iso 0 dist 8.76302 6.00593 8.41236 13.1145 11.7852 7.46394 numMergedOcc 0
36 mol 274 unq 1 iso 0 dist 9.11322 12.4287 8.41236 13.7102 11.7852 7.46394 numMergedOcc 0
37 mol 287 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.0458 9.62532 9.65934 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.0458 9.62532 9.65934 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.0458 9.62532 9.65934 numMergedOcc 0
